CHEBI:75331 - benzotriazole

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ChEBI Name benzotriazole
Definition The simplest member of the class of benzotriazoles that consists of a benzene nucleus fused to a 1H-1,2,3-triazole ring.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H5N3
Net Charge 0
Average Mass 119.12400
Monoisotopic Mass 119.04835
InChI InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)
SMILES c1ccc2[nH]nnc2c1
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
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ChEBI Ontology
Outgoing benzotriazole (CHEBI:75331) has role environmental contaminant (CHEBI:78298)
benzotriazole (CHEBI:75331) has role xenobiotic (CHEBI:35703)
benzotriazole (CHEBI:75331) is a benzotriazoles (CHEBI:48912)
Incoming 1-(2,4-dichlorobenzoyl)-1H-1,2,3-benzotriazole (CHEBI:75330) has functional parent benzotriazole (CHEBI:75331)
Synonyms Sources
1,2,-aminozophenylene ChemIDplus
1,2,3-triaza-1H-indene ChemIDplus
2,3-diazaindole NIST Chemistry WebBook
azimidobenzene ChemIDplus
aziminobenzene ChemIDplus
benzene azimide ChemIDplus
benzisotriazole ChemIDplus
Manual Xrefs Databases
0CT PDBeChem
Benzotriazole Wikipedia
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Registry Numbers Types Sources
112133 Reaxys Registry Number Reaxys
95-14-7 CAS Registry Number NIST Chemistry WebBook
95-14-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
23652707 PubMed citation Europe PMC
23923790 PubMed citation Europe PMC
Last Modified
07 November 2014