2,5-dinitrophenol

2,5-DNP
gamma-dinitrophenol
Phenol, 2,5-dinitro-
Phenol, γ-dinitro-

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	UWEZBKLLMKVIPI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H4N2O5/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3,9H
IUPAC name chemrof:IUPAC_name	2,5-dinitrophenol
Molecular formula chemrof:molecular_formula	C6H4N2O5
Molecular mass chemrof:molecular_mass	184.107
Monoisotopic mass chemrof:monoisotopic_mass	184.01202, 184.012021
SMILES string chemrof:smiles_string	O=[N+]([O-])c1ccc([N+](=O)[O-])c(O)c1

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
beilstein	beilstein:1913411	enrich_references.chebi_xrefs
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=329-71-5	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:40810	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.005.772	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID9022021	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=90441	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL107513	enrich_references.pubchem_identifier_url
gmelin	gmelin:102981	enrich_references.chebi_xrefs
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/HSD25Q268Z	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0245504	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J53.755A	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=52265	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/9492	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1320	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q15726130	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
681b9e75-98fa-44e0-8210-ecb2f4ce257d	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
bed09f7f-cca5-443a-82ab-d49dae95b3d1	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
ab15704a-868a-44f2-a991-a483358bf612	Environmental → Air → Indoor	EF 3.1	kg	2
f35c202c-536e-495d-840f-ddd66fb02868	Environmental → Air → Long-term	EF 3.1	kg	0
9198340d-13db-4a4f-b8cc-31228adae535	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
8a7a5711-0714-449a-9aab-b2151fb11de1	Environmental → Air → Unknown	EF 3.1	kg	2
7a7f3d91-1918-47b9-a4cc-3eb92069c07b	Environmental → Ground → Agricultural	EF 3.1	kg	2
ea66d41b-75f9-4210-98a6-6d0e82909ba5	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
879aba5b-7d2f-44bc-8f7c-89a09d8bfca8	Environmental → Ground → Unknown	EF 3.1	kg	2
4d8b4624-26f3-4b64-818e-0ca4e54acee6	Environmental → Water → Long-term	EF 3.1	kg	0
08ca4d32-54eb-4498-a064-6e0e8e8777e7	Environmental → Water → Ocean	EF 3.1	kg	2
3502ae07-ce13-484a-a6d9-074e2c96836f	Environmental → Water → Surface water	EF 3.1	kg	2
9e8c881a-8d43-4ee2-a264-4594e8c712bd	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
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  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "329-71-5"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=329-71-5"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=329-71-5"
        }
      ],
      "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": [
        "206-348-1"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=206-348-1"
      ],
      "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,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "A dinitrophenol having the nitro groups at the 2- and 5-positions.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_40810"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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

2,5-dinitrophenol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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