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Home > Encyclopedia > Benzoic acid, 3-(chlorosulfonyl)-, methyl ester

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester structure

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester 

structure
  • CAS No:

    63555-50-0

  • Formula:

    C8H7ClO4S

  • Chemical Name:

    Benzoic acid, 3-(chlorosulfonyl)-, methyl ester

  • Synonyms:

    Benzoic acid,3-(chlorosulfonyl)-,methyl ester;Methyl benzoate-3-sulfonyl chloride;Methyl 3-(chlorosulfonyl)benzoate;3-(Methoxycarbonyl)benzenesulfonyl chloride;3-Methoxycarbonylphenylsulfonyl chloride

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester Basic Attributes

234.66

234.66

DTXSID8069935

Characteristics

68.8 Ų

1.431

345.6±25.0 °C(Predicted)

Safety Information

IRRITANT

3261

|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 41 companies from 2 notifications to the ECHA C&L Inventory.

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester Use and Manufacturing

Benzoic acid, 3-(chlorosulfonyl)-, methyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:234.66
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:233.9753576
Monoisotopic Mass:233.9753576
Topological Polar Surface Area:68.8
Heavy Atom Count:14
Complexity:306
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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