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Benzenesulfenyl chloride

Benzenesulfenyl chloride structure

CAS No:
931-59-9
Formula:
C6H5ClS
Chemical Name:
Benzenesulfenyl chloride
Synonyms:
Benzenesulfenyl chloride;Benzene,(chlorothio)-;Phenyl chloro sulfide;Phenylsulfenyl chloride;Phenylsulphenyl chloride;(Chlorothio)benzene;(Chlorosulfanyl)benzene
Categories:
Organic Chemistry > Carboxylic Acids and Derivatives

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Benzenesulfenyl chloride Basic Attributes

Molecular Weight：

144.6219

Exact Mass：

144.62

EC Number：

1312995-182-4

DSSTox ID：

DTXSID60451599

HScode：

2930909090

Characteristics

PSA：

25.3

XLogP3：

3.63

Density：

1.255 g/cm³ @ Temp: 20 °C

Melting Point：

44ºC

Boiling Point：

73-75 °C @ Press: 9 Torr

Flash Point：

110℃

Refractive Index：

1.603

Safety Information

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (97.44%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Benzenesulfenyl chloride Use and Manufacturing

Methods of Manufacturing

It is derived from the chlorination of thiophenol. First add n-heptane (or cyclohexanol) to the three-necked flask, cool to -5-0℃, slowly add thiophenol dropwise while stirring, and at the same time pour dry chlorine into the reaction solution until the solution appears reddish brown When chlorine is stopped, the benzene sulfenyl chloride solution is obtained.

Uses

Intermediate for synthesis of anti-scorching agent PTP.

Computed Properties

Molecular Weight:144.62
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Exact Mass:143.9800490
Monoisotopic Mass:143.9800490
Topological Polar Surface Area:25.3
Heavy Atom Count:8
Complexity:59.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Cyclohexanol

N-Heptane

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