Consensus flow list

Identity

Type
Neutral molecule
CAS
99-34-3
EC
202-751-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 3,5-dinitrobenzoic Acid

Alternative labels

6

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string VYWYYJYRVSBHJQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)
IUPAC name chemrof:IUPAC_name 3,5-dinitrobenzoic Acid
Molecular formula chemrof:molecular_formula C7H4N2O6
Molecular mass chemrof:molecular_mass 212.117
Monoisotopic mass chemrof:monoisotopic_mass 212.006936, 212.00694
SMILES string chemrof:smiles_string O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

Known URLs

16

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=99-34-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:73914 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.501 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.223.384 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7059195 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8732 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL118713 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4V3F9Q018P enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0246067 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J401.383B enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J62.022J enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=66714 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7433 enrich_references.pubchem_compound
reaxys reaxys:1914286 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q223027 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/3,5-Dinitrobenzoic_acid enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
394aaab9-007e-480f-b8f2-ae125257f72c Environmental → Air → Aircraft cruise height EF 3.1 kg 2
38d9d459-3f1a-4be3-9d54-9a7c2d9dd69a Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
8b4d1d15-3bb1-452b-aa15-d4f6619d8b10 Environmental → Air → Indoor EF 3.1 kg 2
610cd8df-b0ea-43ac-a848-ce0847f6942a Environmental → Air → Long-term EF 3.1 kg 0
9f0516d2-b4fc-4ee5-ade0-618ee45bf1d8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
a8048414-0e02-4ad9-a69f-84a8efa67d3d Environmental → Air → Unknown EF 3.1 kg 2
131fd9bd-0e5a-401b-a542-407178650ccb Environmental → Ground → Agricultural EF 3.1 kg 2
12f5e79a-35a3-427c-92e9-680421f93086 Environmental → Ground → Non-agricultural EF 3.1 kg 2
279882fd-7c4e-4561-9417-39b0a80bc196 Environmental → Ground → Unknown EF 3.1 kg 2
10c9b9d3-34e0-4e90-a77a-59827d985d4a Environmental → Water → Long-term EF 3.1 kg 0
94e5d4b3-a62b-4952-ba06-2cb78e689be1 Environmental → Water → Ocean EF 3.1 kg 2
2c443859-e211-4eae-8da9-6c66eb6e739d Environmental → Water → Surface water EF 3.1 kg 2
0bce0e83-e789-4bfa-b37b-d7cf7e113e8c Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
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