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

Catalog Number

ACM116492978

Product Name

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

Structure

CAS

116492-97-8

Category

Heterocyclic Organic Compound

Synonyms

116492-97-8, ST51041588, 3,3-bis(methylthio)-2-[3-(trifluoromethyl)benzoyl]acrylonitrile, 3,3-bis(methylsulfanyl)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile, Benzenepropanenitrile, a-[bis(methylthio)methylene]-b-oxo-3-(trifluoromethyl)-, ZINC00125046, AC1MC4PI, Maybridge4_002130, ACMC-20e1t2, CTK4A9818, MolPort-000-151-565, HMS1527A18, AKOS015852508, AG-D-37939, NCGC00176890-01, KB-105096, A803625, BRD-K67893144-001-01-8, I01-14669, 3,3-Bis(methylthio-2-[3-(trifluoromethyl)benzoyl]acrylonitrile

IUPAC Name

3,3-bis(methylsulfanyl)-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile

Molecular Weight

317.35

Molecular Formula

C₁₃H₁₀F₃NOS₂

Canonical SMILES

CSC(=C(C#N)C(=O)C1=CC(=CC=C1)C(F)(F)F)SC

InChI Key

AWHHDJOLSFGHQP-UHFFFAOYSA-N

Melting Point

60ºC

Exact Mass

317.01600

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

7

H-Bond Donor

0

Safety Description

26-36/37/39

MSDS

COA

Spec Sheet