Nonylphenol

Monononylphenol
n-Nonylphenol
Phenol, nonyl-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	SNQQPOLDUKLAAF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3
IUPAC name chemrof:IUPAC_name	Nonylphenol
Molecular formula chemrof:molecular_formula	C15H24O
Molecular mass chemrof:molecular_mass	220.356
Monoisotopic mass chemrof:monoisotopic_mass	220.182715
SMILES string chemrof:smiles_string	CCCCCCCCCc1ccccc1O

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=25154-52-3	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:79516	enrich_references.chebi_id_link
KEGG	https://www.genome.jp/entry/C14993	enrich_references.chebi_xrefs

Flow	Context	Source	Unit	CFs
ddba84b2-c0f0-4571-9aba-fc2f99d5c650	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
ae1e46b4-2112-43a7-8a93-5fa7e5f9f324	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
7c3f5a4b-78f2-4508-8f7f-684cf789070e	Environmental → Air → Indoor	EF 3.1	kg	2
9d907990-b4ae-4146-974d-8e9f655aa01e	Environmental → Air → Long-term	EF 3.1	kg	0
3a5f61f6-6914-456d-8dac-a76658b27a60	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
0833c8d2-018b-4670-b6ce-ef299e07a94a	Environmental → Air → Unknown	EF 3.1	kg	2
75a5d42f-12a2-4b45-9c75-fbcbd3d57545	Environmental → Ground → Agricultural	EF 3.1	kg	2
d2a214ea-3050-4ae3-8085-753edc2758b8	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
b33819d9-610e-46ef-8b58-65b3f811ec30	Environmental → Ground → Unknown	EF 3.1	kg	2
999a7543-e275-45d3-a653-0ab66b5028e2	Environmental → Water → Long-term	EF 3.1	kg	0
df812aba-db31-4f11-821b-3b2303761121	Environmental → Water → Ocean	EF 3.1	kg	2
79dd31ef-9482-4090-908e-a618b6100194	Environmental → Water → Surface water	EF 3.1	kg	2
0eb42782-e1a9-4ec9-9bfa-4b309cb2736e	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-55880c62cd75dad2",
  "prefLabel": [
    {
      "@value": "Nonylphenol",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Monononylphenol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:25154-52-3",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=25154-52-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "n-Nonylphenol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=25154-52-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phenol, nonyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
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  ],
  "properties": {
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    },
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    },
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      "rdfs:label": "InChI",
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      ],
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        ]
      },
      "attested_by": {
        "SNQQPOLDUKLAAF-UHFFFAOYSA-N": [
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      }
    },
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "rdfs:label": "Molecular formula",
      "@value": [
        "C15H24O"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "rdkit_post_consensus",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
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      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "CCCCCCCCCc1ccccc1O"
        ]
      },
      "attested_by": {
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
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      ],
      "provenance": {
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        ]
      },
      "attested_by": {
        "220.182715": [
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=25154-52-3",
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  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "0833c8d2-018b-4670-b6ce-ef299e07a94a",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
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  "classifications": {
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  "origin_qualifier": null,
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}

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Nonylphenol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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