3-(4-Chloro-benzenesulfonyl)-propionic acid
[CAS# 90396-00-2]

Identification

• Name: 3-(4-Chloro-benzenesulfonyl)-propionic acid
• Synonyms: 3-(4-Chlorophenyl)Sulfonylpropionate; Zinc00110680
• Molecular Formula: C₉H₈ClO₄S
• Molecular Weight: 247.67
• CAS Registry Number: 90396-00-2
• SMILES: C1=C([S](=O)(=O)CCC([O-])=O)C=CC(=C1)Cl
• InChI: 1S/C9H9ClO4S/c10-7-1-3-8(4-2-7)15(13,14)6-5-9(11)12/h1-4H,5-6H2,(H,11,12)/p-1
• InChIKey: ZEYRBFCQZXZIQU-UHFFFAOYSA-M

Properties

• Boiling point: 479.462°C at 760 mmHg (Cal.)
• Flash point: 243.77°C (Cal.)