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Structure

Benzenepropanenitrile,a-[bis(methylthio)methylene]-3-methyl-b-oxo-

CAS
175201-64-6
Catalog Number
ACM175201646
Category
Other Products
Molecular Weight
263.38
Molecular Formula
C13H13NOS2

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Specification

Synonyms
2-(3-METHYLBENZOYL)-3,3-DI(METHYLTHIO)ACRYLONITRILE;3,3-BIS(METHYLTHIO)-2-(3-METHYLBENZOYL)ACRYLONITRILE
IUPAC Name
2-(3-methylbenzoyl)-3,3-bis(methylsulfanyl)prop-2-enenitrile
Canonical SMILES
CC1=CC=CC(=C1)C(=O)C(=C(SC)SC)C#N
InChI Key
YLQJLZBZLQXCQF-UHFFFAOYSA-N
Boiling Point
383.4ºC at 760mmHg
Melting Point
53ºC
Flash Point
185.7ºC
Density
1.209g/cm³
Exact Mass
263.04400
H-Bond Acceptor
4
H-Bond Donor
0
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