Vitas-M small molecule compound

1-(1,3-benzodioxol-5-yl)-N-(4-methoxybenzyl)methanamine

Catalog ID
STK145696
SMILES COc1ccc(cc1)CNCc1ccc2c(c1)OCO2

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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 C16H17NO3 MW 271.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO3/c1-18-14-5-2-12(3-6-14)9-17-10-13-4-7-15-16(8-13)20-11-19-15/h2-8,17H,9-11H2,1H3
InChIKey
GUZQXEQOOYBPGT-UHFFFAOYSA-N
Synonyms
436099-74-0
1(13BENZODIOXOL5YL)N(4METHOXYBENZYL)METHANAMINE
13BENZODIOXOLE5METHANAMINEN((4METHOXYPHENYL)METHYL)HYDROCHLORIDE(11)
436099740
BENZO(13)DIOXO5YLMETHYL(4METHOXYBENZYL)AMINE
BENZO(13)DIOXOL5YLMETHYL(4METHOXYBENZYL)AMI
BENZO(13)DIOXOL5YLMETHYL(4METHOXYBENZYL)AMINE
COC1=CC=C(C=C1)CNCC2=CC3=C(C=C2)OCO3
InChI=1SC16H17NO3c118145212(3614)9171013471516(813)20111915h2817H911H21H3
MFCD01454888
N((4METHOXYPHENYL)METHYL)13BENZODIOXOLE5METHANAMINE
N(13BENZODIOXOL5YLMETHYL)1(4METHOXYPHENYL)METHANAMINE
N(4METHOXYBENZYL)13BENZODIOXOLE5METHANEAMINE
ZINC000000275598
ZINC275598

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Available files

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