Vitas-M small molecule compound

methyl 4-(pentanoylamino)benzoate

Catalog ID
STK141642
SMILES CCCCC(=O)Nc1ccc(cc1)C(=O)OC

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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 C13H17NO3 MW 235.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO3/c1-3-4-5-12(15)14-11-8-6-10(7-9-11)13(16)17-2/h6-9H,3-5H2,1-2H3,(H,14,15)
InChIKey
HIRPPTLJDACDSQ-UHFFFAOYSA-N
Synonyms
127007-34-5
127007345
CCCCC(=O)NC1=CC=C(C=C1)C(=O)OC
InChI=1SC13H17NO3c134512(15)14118610(7911)13(16)172h69H35H212H3(H1415)
METHYL4(PENTANOYLAMINO)BENZOATE
METHYL4VALERYLAMINOBENZOATE
MFCD02339495
ZINC000002057696
ZINC02057696
ZINC2057696

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Available files

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