Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)butan-2-amine

Catalog ID
STK289712
SMILES CCC(NCc1ccc2c(c1)OCO2)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 C12H17NO2 MW 207.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NO2/c1-3-9(2)13-7-10-4-5-11-12(6-10)15-8-14-11/h4-6,9,13H,3,7-8H2,1-2H3
InChIKey
VWVHDPORHNWWNM-UHFFFAOYSA-N
Synonyms
68291-96-3
(2HBENZO(34D)13DIOXOLAN5YLMETHYL)(METHYLPROPYL)AMINE
68291963
BENZO(13)DIOXOL5YLMETHYLSECBUTYLAMINE
CCC(C)NCC1=CC2=C(C=C1)OCO2
InChI=1SC12H17NO2c139(2)13710451112(610)1581411h46913H378H212H3
MFCD04504204
N(13BENZODIOXOL5YLMETHYL)BUTAN2AMINE
N(13BENZODIOXOL5YLMETHYL)N(SECBUTYL)AMINE
ZINC000004897328
ZINC000004897338

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Available files

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