Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate

2,4-Dichloro-6-(4-sulfophenylamino)triazine sodium salt
2,4-Dichloro-6-(p-sulfoanilino)triazine sodium salt
2,6-Dichloro-4-(4-sulfonanilino)-s-triazine sodium salt
4-((4,6-Dichloro-1,3,5-triazine-2-yl)amino) sodium benzenesulfonate
Benzenesulfonic acid, 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-, monosodium salt
Benzenesulfonic acid, 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-, sodium salt (1:1)
p-(2,4-Dichloro-s-triazin-6-ylamino)benzenesulfonic acid sodium salt
Sandospace R
Sodium 2,6-dichloro-s-triazin-4-ylaminobenzene-4-sulfonate
Sodium 4-(2,4-dichloro-s-triazin-6-ylamino)benzenesulfonate
Sodium 4-(4,6-dichloro-s-triazin-2-ylamino)benzenesulfonate
Sodium 4-[(4,6-dichloro-2-triazinyl)amino]benzenesulfonate
Sodium 4-[N-(4,6-dichloro-s-triazin-2-yl)amino]benzenesulfonate
Sodium N-(4,6-dichloro-s-triazin-2-yl)sulfanilate
Sodium p-(4,6-dichloro-2-s-triazinyl)aminobenzenesulfonate
Sulfanilic acid, N-(4,6-dichloro-s-triazin-2-yl)-, monosodium salt
Sulfanilic acid, N-(4,6-dichloro-s-triazin-2-yl)-, sodium salt

Property	Value
InChI2D key string chemrof:inchi2d_key_string	BAINTIMFWTXLNC-UHFFFAOYSA-M, UHZCCKDLKKVJNU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H6Cl2N4O3S.Na/c10-7-13-8(11)15-9(14-7)12-5-1-3-6(4-2-5)19(16,17)18;/h1-4H,(H,16,17,18)(H,12,13,14,15);/q;+1/p-1
IUPAC name chemrof:IUPAC_name	Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate
Molecular formula chemrof:molecular_formula	C9H5Cl2N4NaO3S, C9H6Cl2N4NaO3S
SMILES string chemrof:smiles_string	O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=4156-21-2	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/87229607	enrich_references.pubchem_compound

Flow	Context	Source	Unit	CFs
1bb50f2f-f236-4333-a3c5-dec5f82f0688	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
18e4a551-6aa2-4dc8-b9b2-9d028b8d3478	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
b768214d-3ca9-4733-9d02-da72ef2d684f	Environmental → Air → Indoor	EF 3.1	kg	4
c120f2b5-1b0e-42a7-98eb-486773c6a3f8	Environmental → Air → Long-term	EF 3.1	kg	0
fa56d8b9-14bb-4021-8bc1-a01447188488	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
50bb5d75-dd4d-4de3-abd7-8907b91683a7	Environmental → Air → Unknown	EF 3.1	kg	4
93cecac4-c600-494e-9562-c21844dc0956	Environmental → Ground → Agricultural	EF 3.1	kg	4
eedbd226-66e4-4289-afa4-5f4d4de62079	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
276b1bdb-1c0c-4d6b-baf6-8f22408581a2	Environmental → Ground → Unknown	EF 3.1	kg	4
6b6074d7-a6f7-42bb-b618-f1c09af0be9f	Environmental → Water → Long-term	EF 3.1	kg	0
b2cffd9b-5792-4fae-b7d4-64117fb1a346	Environmental → Water → Ocean	EF 3.1	kg	4
7591f3d2-6c82-4b97-b499-e101b7d2c7be	Environmental → Water → Surface water	EF 3.1	kg	4
4fb0e663-ec79-42dc-a665-fb6ab9afe5d7	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-e3f2bf87595bdf2f",
  "prefLabel": [
    {
      "@value": "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,4-Dichloro-6-(4-sulfophenylamino)triazine sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4-Dichloro-6-(p-sulfoanilino)triazine sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,6-Dichloro-4-(4-sulfonanilino)-s-triazine sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-((4,6-Dichloro-1,3,5-triazine-2-yl)amino) sodium benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenesulfonic acid, 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-, monosodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenesulfonic acid, 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-, sodium salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "p-(2,4-Dichloro-s-triazin-6-ylamino)benzenesulfonic acid sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sandospace R",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium 2,6-dichloro-s-triazin-4-ylaminobenzene-4-sulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium 4-(2,4-dichloro-s-triazin-6-ylamino)benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium 4-(4,6-dichloro-s-triazin-2-ylamino)benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium 4-[(4,6-dichloro-2-triazinyl)amino]benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium 4-[N-(4,6-dichloro-s-triazin-2-yl)amino]benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium N-(4,6-dichloro-s-triazin-2-yl)sulfanilate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium p-(4,6-dichloro-2-s-triazinyl)aminobenzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfanilic acid, N-(4,6-dichloro-s-triazin-2-yl)-, monosodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfanilic acid, N-(4,6-dichloro-s-triazin-2-yl)-, sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4156-21-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C9H5Cl2N4NaO3S",
        "C9H6Cl2N4NaO3S"
      ],
      "attested_by": {
        "C9H6Cl2N4NaO3S": [
          "enrich_references.pubchem_semantic"
        ],
        "C9H5Cl2N4NaO3S": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:87229607"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "BAINTIMFWTXLNC-UHFFFAOYSA-M",
        "UHZCCKDLKKVJNU-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "UHZCCKDLKKVJNU-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic"
        ],
        "BAINTIMFWTXLNC-UHFFFAOYSA-M": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:87229607"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]"
          ]
        }
      ],
      "attested_by": {
        "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C9H6Cl2N4O3S.Na/c10-7-13-8(11)15-9(14-7)12-5-1-3-6(4-2-5)19(16,17)18;/h1-4H,(H,16,17,18)(H,12,13,14,15);/q;+1/p-1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=S(=O)([O-])c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1.[Na+]"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C9H6Cl2N4O3S.Na/c10-7-13-8(11)15-9(14-7)12-5-1-3-6(4-2-5)19(16,17)18;/h1-4H,(H,16,17,18)(H,12,13,14,15);/q;+1/p-1": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate"
        ]
      },
      "attested_by": {
        "Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate": [
          "opsin_iupac"
        ]
      }
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:87229607;CAS:4156-21-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[4156-21-2]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/87229607",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:87229607;CAS:4156-21-2"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[4156-21-2]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "18e4a551-6aa2-4dc8-b9b2-9d028b8d3478",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "multi_component_ionic",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/ChemicalSalt"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.multi_component_ionic"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "4156-21-2"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=4156-21-2"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "223-989-2"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=223-989-2"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/ChemicalSalt"
  ]
}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Sodium 4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

Something wrong here?

Keyboard