1-Chloro-4-[(chloromethyl)thio]benzene
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![1-Chloro-4-[(chloromethyl)thio]benzene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4a4f00d22bcc4ce18feaf2a7fe235acf.png "1-Chloro-4-[(chloromethyl)thio]benzene")
1-Chloro-4-[(chloromethyl)thio]benzene
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CAS No:
7205-90-5
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Formula:
C7H6Cl2S
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Chemical Name:
1-Chloro-4-[(chloromethyl)thio]benzene
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Synonyms:
Benzene,1-chloro-4-[(chloromethyl)thio]-;Sulfide,chloromethyl p-chlorophenyl;1-Chloro-4-[(chloromethyl)thio]benzene;Chloromethyl p-chlorophenyl sulfide;Chloromethyl 4-chlorophenyl sulfide;(4-Chlorophenyl)thiomethyl chloride;(p-Chlorophenylthio)methyl chloride;p-Chlorophenyl chloromethyl sulfide;1-Chloro-4-[(chloromethyl)sulfanyl]benzene
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CAS No:
Characteristics
25.30000
3.67
1.3±0.1 g/cm3
19-21.5 °C
147.5-148.5 °C @ Press: 22 Torr
>230 °F
1.601
Safety Information
III
8
UN 3265 8/PG 2
3
34
26-27-28-36/37/39-45
CZ0200000
C
P280-P305 + P351 + P338-P310
H314
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
1-Chloro-4-[(chloromethyl)thio]benzene Use and Manufacturing
It is derived from the reaction of p-chlorothiophenol with formaldehyde and hydrochloric acid. In a 500L glass-lined reactor, add 200kg of 35% concentrated hydrochloric acid, and slowly add 30kg of 30% formaldehyde under stirring, and add it in about 20min. Then continue stirring for 15 minutes. Heat to 40°C, add dropwise 85kg of p-chlorothiophenol in benzene solution, after the addition, heat up to 55°C to react for 2h, cool to 30°C and let stand for layering, wash the upper layer of sulfide twice with water, and then distill under reduced pressure To benzene, p-chlorobenzene chloromethyl sulfide is obtained.
Intermediate of pesticide trithion.
Benzene, 1-chloro-4-[(chloromethyl)thio]-: ACTIVE
Computed Properties
Molecular Weight:193.09
XLogP3:3.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:191.9567268
Monoisotopic Mass:191.9567268
Topological Polar Surface Area:25.3
Heavy Atom Count:10
Complexity:89.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Chloro-4-[(chloromethyl)thio]benzene
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