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1-Chloro-4-Isothiocyanatobenzene

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1-Chloro-4-Isothiocyanatobenzene / CAS : 2131-55-7

Appearance Light yellow crystal block UN 2811
HS 29309090 DG Class 6.1
Synonyms Benzene,1-Chloro-4-Isothiocyanato; 4-Chlor-Phenyl-Isothiocyanat; P-Chlorophenyl Isothiocyanate; Isothiocyanic Acid,P-Chlorophenyl Ester; Benzene, 1-Chloro-4-Isothiocyanato-; 1-Chloro-4-Isothiocyanato-Benzene; 4-Chlorophenyl Isothiocyanate; Isothiocyanic Acid 4-Chlorophenyl Ester; P-Cl-Ph-Ncs; 4-Chlorophenylisothiocyanate
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Properties

Summary

Formula
C7H4ClNS
Molecular Mass
169.63100
Exact Mass
168.97500
PSA
44.45000
Logp
3.07430
IUPAC
1-chloro-4-isothiocyanatobenzene
SMILES
C1=CC(=CC=C1N=C=S)Cl

Attribute classification

Matter Classification
organic
Category
Auxiliary > Other Auxiliary Agent

Chemical and Physical Properties

Melting Point
42-44 °C
Density
1.3181 (rough estimate)
Boiling Point
135-136 °C24 mm Hg
Flash Point
110 °C
Appearance
Light yellow crystal block
Acidity and Basicity
neutral

Export information

HS Code
29309090
Export Rebate
13%
UN No.
2811
DG-Class
6.1
Risk Code
R23/24-36/37/38-42-42/43-23/24/25
Safety Label
T

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