Vitas-M small molecule compound

4-chloro-N-(3-methylpent-1-yn-3-yl)benzamide

Catalog ID
STK770497
SMILES CCC(NC(=O)c1ccc(cc1)Cl)(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 C13H14ClNO MW 235.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClNO/c1-4-13(3,5-2)15-12(16)10-6-8-11(14)9-7-10/h1,6-9H,5H2,2-3H3,(H,15,16)
InChIKey
RZNCHSQULBAJPY-UHFFFAOYSA-N
Synonyms

(4CHLOROPHENYL)N(1ETHYL1METHYLPROP2YNYL)CARBOXAMIDE
4chloroN(3methylpent1yn3yl)benzamide
CCC(C)(C#C)NC(=O)C1=CC=C(C=C1)Cl
InChI=1SC13H14ClNOc1413(352)1512(16)106811(14)9710h169H5H223H3(H1516)
MFCD03766239
ZINC000000099719
ZINC000000099721

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Available files

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