Vitas-M small molecule compound

1H-benzotriazol-1-yl(4-tert-butylphenyl)methanone

Catalog ID
STK395666
SMILES O=C(n1nnc2c1cccc2)c1ccc(cc1)C(C)(C)C

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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 C17H17N3O MW 279.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O/c1-17(2,3)13-10-8-12(9-11-13)16(21)20-15-7-5-4-6-14(15)18-19-20/h4-11H,1-3H3
InChIKey
CCJUORRTMBZRPC-UHFFFAOYSA-N
Synonyms
59046-29-6
(1HBENZO(D)(123)TRIAZOL1YL)(4(TERTBUTYL)PHENYL)METHANONE
1(4TERTBUTYLBENZOYL)1H123BENZOTRIAZOLE
1Hbenzotriazol1yl(4tertbutylphenyl)methanone
59046296
BENZOTRIAZOL1YL(4TERTBUTYLPHENYL)METHANONE
BENZOTRIAZOLYL4(TERTBUTYL)PHENYLKETONE
CC(C)(C)C1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3N=N2
InChI=1SC17H17N3Oc117(23)1310812(91113)16(21)2015754614(15)181920h411H13H3
MFCD01138561
ZINC000000066505
ZINC00066505
ZINC66505

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Available files

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