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N-(2-nitrophenyl)phosphoric Triamide

fo-c826389444c52b80

Identity

Type
Neutral molecule
CAS
874819-71-3
EC
477-690-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N-(2-nitrophenyl)phosphoric Triamide

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GDPVISFVPDYFPN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H9N4O3P/c7-14(8,13)9-5-3-1-2-4-6(5)10(11)12/h1-4H,(H5,7,8,9,13)
IUPAC name chemrof:IUPAC_name N-(2-nitrophenyl)phosphoric Triamide
Molecular formula chemrof:molecular_formula C6H9N4O3P
Molecular mass chemrof:molecular_mass 216.137
Monoisotopic mass chemrof:monoisotopic_mass 216.041227
SMILES string chemrof:smiles_string NP(N)(=O)Nc1ccccc1[N+](=O)[O-]

Known URLs

7

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=874819-71-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.105.163 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.131.614 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID40470389 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.607.421E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11672960 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q82298468 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
ef9d5bed-af37-46b4-b348-cde39168a04e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
086d55cf-1528-44fc-a073-2765ed1e647d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
672cacab-badc-4cae-9594-0798a6c5733a Environmental → Air → Indoor EF 3.1 kg 4
841fa98c-4aa5-46a7-8818-1bb5e220772d Environmental → Air → Long-term EF 3.1 kg 0
3fc32ff3-08ec-4527-8a8b-d2e838c53153 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
3de53b9d-f83e-4d69-a28d-5af39834c8ec Environmental → Air → Unknown EF 3.1 kg 4
48e9934f-e6e0-4d7e-a894-2ed1bffc15e9 Environmental → Ground → Agricultural EF 3.1 kg 4
5f840493-0b7f-42cd-ab7e-c8aa12c200a1 Environmental → Ground → Non-agricultural EF 3.1 kg 4
9fc321fd-769c-478d-ae9e-dc7cb73521f3 Environmental → Ground → Unknown EF 3.1 kg 4
25679b09-3863-4a05-bbf2-a4cd5905718e Environmental → Water → Long-term EF 3.1 kg 0
85d7e53a-91fa-48ec-b650-a3f3cf7ff90f Environmental → Water → Ocean EF 3.1 kg 4
1043ccb2-dc6c-475c-acf4-f19d05cbaa93 Environmental → Water → Surface water EF 3.1 kg 4
0682d159-456e-42e7-bdb9-79b36102f55c Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-c826389444c52b80",
  "prefLabel": [
    {
      "@value": "N-(2-nitrophenyl)phosphoric Triamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "N-(2-Nitrophenyl)phosphoric acid triamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=874819-71-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phosphoric triamide, (2-nitrophenyl)-",
      "@language": "en",
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phosphoric triamide, N-(2-nitrophenyl)-",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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  ],
  "properties": {
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      ],
      "attested_by": {
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    },
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      ],
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      },
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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          ]
        }
      ],
      "attested_by": {
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          "rdkit_post_consensus",
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
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      "provenance": {
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  ],
  "created_from": {
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    "seed_uuid": "0682d159-456e-42e7-bdb9-79b36102f55c",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "reason": "",
      "types": [
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      ],
      "provenance": {
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  },
  "classifications": {
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      "rdfs:seeAlso": [
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      "provenance": {
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  "origin_qualifier": null,
  "parent_flow_object_id": null,
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  "@type": [
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  ]
}

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