Vitas-M small molecule compound

1H-benzotriazol-1-yl(3-bromophenyl)methanone

Catalog ID
STK050890
SMILES Brc1cccc(c1)C(=O)n1nnc2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H8BrN3O MW 302.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8BrN3O/c14-10-5-3-4-9(8-10)13(18)17-12-7-2-1-6-11(12)15-16-17/h1-8H
InChIKey
FDODEPGJMIPNBK-UHFFFAOYSA-N
Synonyms
314767-38-9
(1Hbenzo(d)(123)triazol1yl)(3bromophenyl)methanone
1HBENZOTRIAZOL1YL(3BROMOPHENYL)METHANONE
314767389
BENZOTRIAZOL1YL(3BROMOPHENYL)METHANONE
BENZOTRIAZOLYL3BROMOPHENYLKETONE
Brc1cccc(c1)C(=O)n1nnc2c1cccc2
C1=CC=C2C(=C1)N=NN2C(=O)C3=CC(=CC=C3)Br
InChI=1SC13H8BrN3Oc14105349(810)13(18)1712721611(12)151617h18H
MFCD00554088
STK050890
ZINC000000191035
ZINC00191035
ZINC191035

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.