2-Chloroethyl p-toluenesulfonate
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2-Chloroethyl p-toluenesulfonate
structure -
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CAS No:
80-41-1
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Formula:
C9H11ClO3S
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Chemical Name:
2-Chloroethyl p-toluenesulfonate
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Synonyms:
Ethanol,2-chloro-,1-(4-methylbenzenesulfonate);Ethanol,2-chloro-,4-methylbenzenesulfonate;Ethanol,2-chloro-,p-toluenesulfonate;2-Chloroethanol p-toluenesulfonate;2-Chloroethyl p-toluenesulfonate;2-Chloroethyl p-tosylate;β-Chloroethyl p-toluenesulfonate;2-Chloroethyl tosylate;2-(p-Toluenesulfonyloxy)ethyl chloride;2-Chloroethyl 4-methylbenzenesulfonate;2-Chloroethanol tosylate;2-Tosyloxyethyl chloride;β-Chloroethyl tosylate;2-Chloro-1-(p-toluenesulfonyl)ethane;NSC 6079;Toluene-4-sulfonic acid 2-chloroethyl ester;p-Toluenesulfonic acid 2-chloroethyl ester;2-Chloroethyl 4-methylbenzene-1-sulfonate;56215-02-2;85426-03-5;344310-40-3
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CAS No:
Characteristics
51.8
2
Clear colorless to yellow Liquid
1.361 g/cm3 @ Temp: 20 °C
22.5-23.0 °C
210 °C @ Press: 21 Torr
>230 °F
1.529
0-6°C
Oral-Rat LD50: 498 mg/kg
Combustible; Fire site decomposes toxic chloride, sulfur oxide gas
Safety Information
III
6.1
2810
3
22
23-36/37/39-24/25
XT6475000
Xn
Storeroom low temperature, ventilated, dry; fireproof; stored separately from oxidants, food ingredients
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 50 companies from 3 notifications to the ECHA C&L Inventory.
2-Chloroethyl p-toluenesulfonate Use and Manufacturing
Derived from the reaction of p-toluenesulfonyl chloride and chloroethanol.
Ethanol, 2-chloro-, 1-(4-methylbenzenesulfonate): ACTIVE
Computed Properties
Molecular Weight:234.70
XLogP3:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:234.0117431
Monoisotopic Mass:234.0117431
Topological Polar Surface Area:51.8
Heavy Atom Count:14
Complexity:250
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Chloroethyl p-toluenesulfonate
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