Consensus flow list

5-nitrobenzotriazole

fo-d0e902be5e8b324f

Identity

Type
Neutral molecule
CAS
2338-12-7
EC
219-047-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 5-nitrobenzotriazole

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string AOCDQWRMYHJTMY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H4N4O2/c11-10(12)4-1-2-5-6(3-4)8-9-7-5/h1-3H,(H,7,8,9)
IUPAC name chemrof:IUPAC_name 5-nitrobenzotriazole
Molecular formula chemrof:molecular_formula C6H4N4O2
Molecular mass chemrof:molecular_mass 164.124
Monoisotopic mass chemrof:monoisotopic_mass 164.033425
SMILES string chemrof:smiles_string O=[N+]([O-])c1ccc2[nH]nnc2c1

Known URLs

12

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=2338-12-7 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.017.316 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2062329 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=3132 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=66476 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1414349 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/MBZ62VSZ9Z enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J36.091K enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/61301 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#0385 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=021215 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27453965 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
1f9692f1-d784-477c-8e9a-3e0d9f5bd1cb Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3ab45c38-04a1-4aab-9434-f5b644168165 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
231b2bfb-a25f-4e55-a7c2-fc0e023b5866 Environmental → Air → Indoor EF 3.1 kg 2
5c6a3767-a672-4765-9cac-1eca69fb0448 Environmental → Air → Long-term EF 3.1 kg 0
fa9d5a98-c996-4345-a0b4-c100cdd095d9 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b4d63980-90fb-4518-b9d1-a367b4d370ed Environmental → Air → Unknown EF 3.1 kg 2
c2ed078a-d6c4-473c-9982-0efde71c27ff Environmental → Ground → Agricultural EF 3.1 kg 2
d8b8bad3-a9b9-4812-8ba6-7975e8f75fb9 Environmental → Ground → Non-agricultural EF 3.1 kg 2
fe721763-6591-4ab7-b6be-23c57fd9c92f Environmental → Ground → Unknown EF 3.1 kg 2
dcbd261b-2433-4e30-8825-8b6fdb7edf65 Environmental → Water → Long-term EF 3.1 kg 0
5e0901ea-9021-4407-87de-91dcc622809c Environmental → Water → Ocean EF 3.1 kg 2
59ede396-d7d3-42e8-80e2-82359d7da46c Environmental → Water → Surface water EF 3.1 kg 2
bd90f3f7-225c-459f-89b2-f2b6631fe8ef Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
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