5-nitroindazole

1H-Indazole, 5-nitro-
5-Nitro-1H-benzopyrazole
5-Nitro-1H-indazole
Indazole, 5-nitro-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	WSGURAYTCUVDQL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C7H5N3O2/c11-10(12)6-1-2-7-5(3-6)4-8-9-7/h1-4H,(H,8,9)
IUPAC name chemrof:IUPAC_name	5-nitroindazole
Molecular formula chemrof:molecular_formula	C7H5N3O2
Molecular mass chemrof:molecular_mass	163.136
Monoisotopic mass chemrof:monoisotopic_mass	163.038176
SMILES string chemrof:smiles_string	O=[N+]([O-])c1ccc2[nH]ncc2c1

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=5401-94-5	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.024.046	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID5049316	enrich_references.pubchem_identifier_url
drugbank.ca	https://www.drugbank.ca/drugs/DB04534	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=5032	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL165372	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/235Y7P37ZD	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.232B	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=148978	enrich_references.pubchem_identifier_url
platform.opentargets.org	https://platform.opentargets.org/drug/CHEMBL165372	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/21501	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27253724	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
bb3946b3-c336-4c02-93ca-f3c6379f958b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
e706c147-79c1-40f7-849c-ffda55440027	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
d27eeb64-2134-418b-ac30-23be5b5b151a	Environmental → Air → Indoor	EF 3.1	kg	2
5f95dbbe-ec21-40c9-928c-4ef3c8647552	Environmental → Air → Long-term	EF 3.1	kg	0
6a7b13f7-0940-4c98-9a3a-24b2b2bf0598	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
ad15ab8f-85de-4352-9e6f-af54487cf8b9	Environmental → Air → Unknown	EF 3.1	kg	2
81e7d2df-50d4-4cb2-836f-7a1608dd5c7d	Environmental → Ground → Agricultural	EF 3.1	kg	2
d49301ff-72fc-4f71-a9da-60e2c455c09f	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
2bf50056-8fae-49c7-ab67-c75c2636caae	Environmental → Ground → Unknown	EF 3.1	kg	2
10baa038-8758-45ad-a58c-8a4ff66f8916	Environmental → Water → Long-term	EF 3.1	kg	0
3577cf5c-532f-4f47-832f-7ee2faea938d	Environmental → Water → Ocean	EF 3.1	kg	2
f0062e70-0cc9-4635-91b9-b91b69ba0713	Environmental → Water → Surface water	EF 3.1	kg	2
708389c6-bef1-4767-99ac-1f8effabb15d	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

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Flow object JSON

{
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}

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5-nitroindazole

Identity

Structure

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Properties

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