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Structure

Benzoylisothiocyanate,3-chloro-

CAS
66090-36-6
Catalog Number
ACM66090366
Category
Other Products
Molecular Weight
197.64
Molecular Formula
C8H4ClNOS

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Specification

Synonyms
3-chlorobenzoyl isothiocyanate, 66090-36-6, ZINC02390100, AC1MBVRZ, Benzoylisothiocyanate, 3-chloro-, CTK2F2594, MolPort-000-152-731, AKOS009076008, (3-chlorophenyl)-isothiocyanatomethanone, (3-chlorophenyl)-isothiocyanato-methanone, KB-86647, FT-0641046, A835331, I01-14270
IUPAC Name
3-chlorobenzoyl isothiocyanate
Canonical SMILES
C1=CC(=CC(=C1)Cl)C(=O)N=C=S
InChI Key
ZUISLKTWVWIULT-UHFFFAOYSA-N
Boiling Point
140ºC/6mm
Melting Point
140ºC
Flash Point
136.3ºC
Density
1.29g/cm³
Exact Mass
196.97000
Hazard Statements
Xi,C
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
S26-S36-S37-S39
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