Cas no 41538-39-0 (Benzoic acid, 2-(aminosulfonyl)-, 2-propenyl ester)

Benzoic acid, 2-(aminosulfonyl)-, 2-propenyl ester structure
41538-39-0 structure
Product Name:Benzoic acid, 2-(aminosulfonyl)-, 2-propenyl ester
CAS No:41538-39-0
MF:C10H11NO4S
MW:241.26364159584
CID:323955
PubChem ID:70539814
Update Time:2025-04-19

Benzoic acid, 2-(aminosulfonyl)-, 2-propenyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-(aminosulfonyl)-, 2-propenyl ester
    • prop-2-enyl 2-sulfamoylbenzoate
    • allyl 2-sulfamoylbenzoate
    • Prop-2-en-1-yl 2-sulfamoylbenzoate
    • DTXSID30742365
    • SCHEMBL11214179
    • Allyl-o-sulfamoylbenzoat
    • 41538-39-0
    • Inchi: 1S/C10H11NO4S/c1-2-7-15-10(12)8-5-3-4-6-9(8)16(11,13)14/h2-6H,1,7H2,(H2,11,13,14)
    • InChI Key: FBLXAWLCPWREDG-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1C(=O)OCC=C)(N)(=O)=O

Computed Properties

  • Exact Mass: 241.04087901g/mol
  • Monoisotopic Mass: 241.04087901g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 358
  • 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
  • Topological Polar Surface Area: 94.8?2
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