Vitas-M small molecule compound

3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazole

Catalog ID
STK933661
SMILES Brc1ncn(n1)CCc1ccccc1

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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 C10H10BrN3 MW 252.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10BrN3/c11-10-12-8-14(13-10)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2
InChIKey
VIUXHHYWIJPKBC-UHFFFAOYSA-N
Synonyms
1219546-16-3
1219546163
3bromo1(2phenylethyl)124triazole
3bromo1(2phenylethyl)1H124triazole
3BROMO1PHENETHYL1H124TRIAZOLE
C1=CC=C(C=C1)CCN2C=NC(=N2)Br
InChI=1SC10H10BrN3c111012814(1310)769421359h158H67H2
MFCD16090157
ZINC000040162985
ZINC40162985

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Available files

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