Vitas-M small molecule compound
2-cyano-2-methyl-1-phenylpropyl benzoate
Catalog ID
STK098382
SMILES N#CC(C(c1ccccc1)OC(=O)c1ccccc1)(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 C18H17NO2 MW 279.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO2/c1-18(2,13-19)16(14-9-5-3-6-10-14)21-17(20)15-11-7-4-8-12-15/h3-12,16H,1-2H3InChIKey
BNJQVPUJEJITJL-UHFFFAOYSA-NSynonyms
315194-76-4(2CYANO2METHYL1PHENYLPROPYL)BENZOATE
2CYANO2METHYL1PHENYLPROPYLBENZOATE
315194764
CC(C)(C#N)C(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2
InChI=1SC18H17NO2c118(21319)16(1495361014)2117(20)15117481215h31216H12H3
MFCD00416439
N#CC(C(c1ccccc1)OC(=O)c1ccccc1)(C)C
STK098382
ZINC000000501260
ZINC000000501261
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