Consensus flow list

Identity

Type
Neutral molecule
CAS
552-16-9
EC
209-004-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
30 across every transformer

Structure

Structure diagram for 2-Nitrobenzoic Acid

Alternative labels

4

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SLAMLWHELXOEJZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)
IUPAC name chemrof:IUPAC_name 2-Nitrobenzoic Acid
Molecular formula chemrof:molecular_formula C7H5NO4
Molecular mass chemrof:molecular_mass 167.12
Monoisotopic mass chemrof:monoisotopic_mass 167.021858, 167.02186
SMILES string chemrof:smiles_string O=C(O)c1ccccc1[N+](=O)[O-]

Known URLs

19

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=552-16-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:25620 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.008.187 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5025738 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=9576 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL114719 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S6S4653K7Z enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0245255 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.389.648H enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.613F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C16234 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C16234 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=53981 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=CPD-9168 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11087 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/23123905 enrich_references.chebi_xrefs
reaxys reaxys:1910632 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q19810380 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/2-Nitrobenzoic_acid enrich_references.pubchem_identifier_url

Elementary flows

5
Flow Context Source Unit CFs
15ddc39b-0613-4506-ae40-64b8a9442b23 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
d625cae4-1c02-49fe-a4cd-950d2c73198e Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
c7f2d29a-5bc9-408e-9c61-f3991d49628c Environmental → Air → Long-term EF 3.1 kg 0
f519c46c-70b6-4f71-9a18-3d80de2387d6 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
05d4bbf75292268f9f39153d937a4f894d828520 Environmental → Air → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (30 changes)

Open the changes page

Full record

Flow object JSON
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        "552-16-9"
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      ],
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "A nitrobenzoic acid carrying the nitro substituent at position 2.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
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      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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