Vitas-M small molecule compound

N,N-dihexyl-1,3-benzodioxole-5-carboxamide

Catalog ID
STK426899
SMILES CCCCCCN(C(=O)c1ccc2c(c1)OCO2)CCCCCC

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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 C20H31NO3 MW 333.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31NO3/c1-3-5-7-9-13-21(14-10-8-6-4-2)20(22)17-11-12-18-19(15-17)24-16-23-18/h11-12,15H,3-10,13-14,16H2,1-2H3
InChIKey
CGFBTZVWSIRZBI-UHFFFAOYSA-N
Synonyms

2HBENZO(34D)13DIOXOLAN5YLNNDIHEXYLCARBOXAMIDE
CCCCCCN(CCCCCC)C(=O)C1=CC2=C(C=C1)OCO2
InChI=1SC20H31NO3c135791321(14108642)20(22)1711121819(1517)24162318h111215H310131416H212H3
MFCD02605477
NNdihexyl13benzodioxole5carboxamide
ZINC000002748832
ZINC02748832
ZINC2748832

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Available files

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