Vitas-M small molecule compound

N-(1,3-benzodioxol-5-yl)-2-ethylbutanamide

Catalog ID
STK167755
SMILES CCC(C(=O)Nc1ccc2c(c1)OCO2)CC

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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/c1-3-9(4-2)13(15)14-10-5-6-11-12(7-10)17-8-16-11/h5-7,9H,3-4,8H2,1-2H3,(H,14,15)
InChIKey
WKLKHFDOQVYRJB-UHFFFAOYSA-N
Synonyms

CCC(CC)C(=O)NC1=CC2=C(C=C1)OCO2
InChI=1SC13H17NO3c139(42)13(15)1410561112(710)1781611h579H348H212H3(H1415)
MFCD02918130
N(13BENZODIOXOL5YL)2ETHYLBUTANAMIDE
ZINC000000453058
ZINC00453058
ZINC453058

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Available files

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