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Structure

4-Isothiocyanatobenzoyl chloride

CAS
53611-24-8
Catalog Number
ACM53611248
Category
Other Products
Molecular Weight
197.64146
Molecular Formula
C8H4ClNOS

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Specification

Synonyms
4-ISOTHIOCYANATOBENZOYL CHLORIDE;Benzoyl chloride, 4-isothiocyanato- (9CI)
IUPAC Name
4-isothiocyanatobenzoyl chloride
Canonical SMILES
C1=CC(=CC=C1C(=O)Cl)N=C=S
InChI Key
WPRKKGAKYQGUBI-UHFFFAOYSA-N
Boiling Point
316ºC at 760 mmHg
Flash Point
144.9ºC
Density
1.29g/cm³
Exact Mass
196.97000
H-Bond Acceptor
3
H-Bond Donor
0
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