Cas no 168330-41-4 (benzenesulfonic acid, 4-chloro-, hydrate (2:1))

benzenesulfonic acid, 4-chloro-, hydrate (2:1) structure
168330-41-4 structure
Product Name:benzenesulfonic acid, 4-chloro-, hydrate (2:1)
CAS No:168330-41-4
MF:C6H7ClO4S
MW:210.635380029678
CID:1349009
Update Time:2024-08-17

benzenesulfonic acid, 4-chloro-, hydrate (2:1) Chemical and Physical Properties

Names and Identifiers

    • benzenesulfonic acid, 4-chloro-, hydrate (2:1)
    • 4-Chlorobenzenesulfonic acid hydrate (2:1)
    • LogP
    • Inchi: 1S/C6H5ClO3S.H2O/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4H,(H,8,9,10);1H2
    • InChI Key: JCARZMZFSSKOAW-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(Cl)=CC=1)(O)(=O)=O.O

Computed Properties

  • Exact Mass: 401.94026

Experimental Properties

  • PSA: 140.24
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