Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-4-chloroaniline

Catalog ID
STK510901
SMILES Clc1ccc(cc1)NCc1ccc2c(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 C14H12ClNO2 MW 261.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClNO2/c15-11-2-4-12(5-3-11)16-8-10-1-6-13-14(7-10)18-9-17-13/h1-7,16H,8-9H2
InChIKey
QNSGPBQRNKLKKS-UHFFFAOYSA-N
Synonyms
79185-47-0
79185470
BENZO(13)DIOXOL5YLMETHYL(4CHLOROPHENYL)AMINE
C1OC2=C(O1)C=C(C=C2)CNC3=CC=C(C=C3)Cl
InChI=1SC14H12ClNO2c15112412(5311)16810161314(710)1891713h1716H89H2
MFCD00441532
N(13benzodioxol5ylmethyl)4chloroaniline
N(13BENZODIOXOL5YLMETHYL)N(4CHLOROPHENYL)AMINE
N(benzo(d)(13)dioxol5ylmethyl)4chloroaniline
ZINC000000576238
ZINC00576238
ZINC576238

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Available files

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