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Structure

2-Chlorobenzyl mercaptan

CAS
39718-00-8
Catalog Number
ACM39718008-1
Category
Solvents
Molecular Weight
158.64
Molecular Formula
C7H7ClS

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Specification

Synonyms
2-Chlorobenzenemethanethiol, 2-Chlorothiosanisole, 1-Chloro-2-(methylsulfanyl)benzene, (2-Chlorophenyl)methanethiol, Benzene, 1-chloro-2-(methylthio)-
IUPAC Name
1-chloro-2-(methylsulfanyl)benzene
Canonical SMILES
CSC1=CC=CC=C1Cl
InChI Key
IHLDFHCSSCVPQW-UHFFFAOYSA-N
Boiling Point
211.1±23.0 °C at 760 mmHg
Flash Point
69.4±0.0 °C
Density
1.2±0.1 g/cm3
Assay
≥96.0%
Color
Clear colorless to pale yellow
EC Number
254-602-5
Exact Mass
157.995697
Form
Liquid
Hazard Codes
Xi: Irritant;
Hazard Statements
H315-H319-H335
LogP
3.46
MDL Number
MFCD00004868
PSA
38.8
Refractive Index
1.588
Vapor Pressure
0.3±0.4 mmHg at 25°C
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