Cas no 29710-58-5 (1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate)

1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate structure
29710-58-5 structure
Product Name:1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate
CAS No:29710-58-5
MF:C10H9ClO6S
MW:292.692861318588
CID:1442603
PubChem ID:3789197
Update Time:2025-04-20

1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate Chemical and Physical Properties

Names and Identifiers

    • 1,3-Benzenedicarboxylic acid, 5-(chlorosulfonyl)-, dimethyl ester
    • dimethyl 5-(chlorosulfonyl)isophthalate
    • dimethyl 5-chlorosulfonylbenzene-1,3-dicarboxylate
    • DB-307842
    • 3,5-Dimethoxycarbonylbenzenesulfonyl chloride
    • 29710-58-5
    • GS3037
    • DTXSID501157752
    • AKOS001074083
    • EN300-06759
    • SCHEMBL2324813
    • 5-Chlorosulfonyl-isophthalic acid dimethyl ester
    • 5-chlorosulfonylisophthalic acid dimethyl ester
    • AB20839
    • dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate
    • 1,3-DIMETHYL5-(CHLOROSULFONYL)BENZENE-1,3-DICARBOXYLATE
    • 1,3-DIMETHYL 5-(CHLOROSULFONYL)BENZENE-1,3-DICARBOXYLATE
    • 1,3-Benzenedicarboxylic acid, 5-(chlorosulfonyl)-, 1,3-dimethyl ester
    • 1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate
    • Inchi: 1S/C10H9ClO6S/c1-16-9(12)6-3-7(10(13)17-2)5-8(4-6)18(11,14)15/h3-5H,1-2H3
    • InChI Key: OLELLCDSABPKEP-UHFFFAOYSA-N
    • SMILES: ClS(C1C=C(C(=O)OC)C=C(C(=O)OC)C=1)(=O)=O

Computed Properties

  • Exact Mass: 291.98087
  • Monoisotopic Mass: 291.981
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 402
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.7
  • Topological Polar Surface Area: 95.1?2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Melting Point: NA
  • Boiling Point: 423.0±35.0 °C at 760 mmHg
  • Flash Point: 209.6±25.9 °C
  • PSA: 86.74
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate Security Information

1,3-Dimethyl 5-(chlorosulfonyl)benzene-1,3-dicarboxylate Pricemore >>

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