2-Propene-1-sulfonic acid, 2-methyl-, ion(1-)
Basic information
- CAS
345909-54-8- Standard SMILES
C=C(C)CS(=O)(=O)[O-]- InChIKey
XEEYSDHEOQHCDA-UHFFFAOYSA-M- Molecular formula
- C4H7O3S-
- Average molar mass
- 135.16 g/mol
- Monoisotopic mass
- 135.01159025
Names & identifiers
- Preferred name
- 2-Propene-1-sulfonic acid, 2-methyl-, ion(1-)
- IUPAC
- 2-methylprop-2-ene-1-sulfonate
Names & synonyms
2-Propene-1-sulfonic acid, 2-methyl-, ion(1-)345909-54-8RefChem:2662202-methylprop-2-enesulfonic acid2-methylprop-2-ene-1-sulfonateDTXSID701252564NS00067017ST45026059
Database identifiers
- CAS
345909-54-8- PubChem CID
- 3262020
- DTXSID
DTXSID701252564
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- -1
- Complexity
- 159
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Compound notes
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