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Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester

Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester structure

CAS No:
10486-51-8
Formula:
C9H9ClO4S
Chemical Name:
Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester
Synonyms:
Benzoic acid,4-(chlorosulfonyl)-,ethyl ester;Benzoic acid,p-(chlorosulfonyl)-,ethyl ester;4-(Ethoxycarbonyl)benzenesulfonyl chloride;Ethyl 4-chlorosulfonylbenzoate

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Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester Basic Attributes

Molecular Weight：

248.677

Exact Mass：

248.68

DSSTox ID：

DTXSID90394844

HScode：

2916399090

Characteristics

PSA：

68.8

XLogP3：

2.8

Density：

1.377±0.06 g/cm3(Predicted)

Boiling Point：

346.0±25.0 °C(Predicted)

Vapor Pressure：

5.94E-05mmHg at 25°C

Safety Information

Precautionary statement(s)：

P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, P501

Hazard Statements：

H314

GHS Classification：

|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 19 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:248.68
XLogP3:2.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:247.9910076
Monoisotopic Mass:247.9910076
Topological Polar Surface Area:68.8
Heavy Atom Count:15
Complexity:312
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Benzoic acid, 4-(chlorosulfonyl)-, ethyl ester

SDS

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