Calcium di(benzenesulphonate)
Basic information
- CAS
934-54-3- Standard SMILES
O=S(=O)([O-])c1ccccc1.O=S(=O)([O-])c1ccccc1.[Ca+2]- InChIKey
VJOCYCQXNTWNGC-UHFFFAOYSA-L- Molecular formula
- C12H10CaO6S2
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 353.9544712
Overview
See also: Calcium benzenesulfonate (annotation moved to).
Names & identifiers
- Preferred name
- Calcium di(benzenesulphonate)
- IUPAC
- calcium benzenesulfonate
Names & synonyms
Calcium di(benzenesulphonate)calcium bisbenzenesulfonateEINECS 213-285-3SCHEMBL587792DTXSID40239413VJOCYCQXNTWNGC-UHFFFAOYSA-LNS00079729
Database identifiers
- CAS
934-54-3- PubChem CID
- 71591
- DTXSID
DTXSID40239413- Nikkaji
- J298.522E
Properties
Computed structural properties
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 170
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Related reactions
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Compound notes
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