1-Hydroxy-2-methyl-1-propanesulfonic acid
Basic information
- CAS
13023-74-0- Standard SMILES
CC(C)C(O)S(=O)(=O)O- InChIKey
YZAFPKJXZHOOIN-UHFFFAOYSA-N- Molecular formula
- C4H10O4S
- Average molar mass
- 154.19 g/mol
- Monoisotopic mass
- 154.02997997
Names & identifiers
- Preferred name
- 1-Hydroxy-2-methyl-1-propanesulfonic acid
- IUPAC
- 1-hydroxy-2-methylpropane-1-sulfonic acid
Names & synonyms
1-hydroxy-2-methylpropane-1-sulfonic acid1-Hydroxy-2-methyl-1-propanesulfonic acid108725-89-913023-74-0NSC 64884NSC648841-hydroxy-2-methyl-propane-1-sulfonic acidSCHEMBL12164283SCHEMBL20420698NAA02374G50546EN300-7235193
Database identifiers
- CAS
13023-74-0- PubChem CID
- 414869
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 83 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 163
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Compound notes
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