Structure

Carbamodithioic acid,N-(1H-indol-3-ylmethyl)-,methyl ester

CAS
105748-59-2
Catalog Number
ACM105748592
Category
Other Products
Molecular Weight
236.3564
Molecular Formula
C11H12N2S2

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Specification

Synonyms
BRASSININ;1H-(INDOL-3-YLMETHYL)-DITHIOCARBAMIC ACID, METHYL ESTER;[(1H-Indole-3-yl)methyl]dithiocarbamic acid methyl ester;1H-Indole-3-ylmethyldithiocarbamic acid methyl ester;Brassinine;N-[(1H-Indol-3-yl)methyl]dithiocarbamic acid methyl ester
IUPAC Name
methyl N-(1H-indol-3-ylmethyl)carbamodithioate
SMILES
CSC(=S)NCC1=CNC2=CC=CC=C21
InChI Key
QYKQWFZDEDFELK-UHFFFAOYSA-N
Boiling Point
436.9ºC at 760 mmHg
Melting Point
132-133ºC
Flash Point
218ºC
Density
1.32 g/cm³
Appearance
Off-White to Pale Yellow Solid
Exact Mass
236.04400
H-Bond Acceptor
0
H-Bond Donor
2

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