Basic information
- CAS
7134-03-4- Standard SMILES
Cc1ccc(S(=O)(=O)O)cc1O- InChIKey
YARIFRHBFXEJNY-UHFFFAOYSA-N- Molecular formula
- C7H8O4S
- Average molar mass
- 188.2 g/mol
- Monoisotopic mass
- 188.01432991
Names & identifiers
- Preferred name
- 3-Hydroxy-4-methylbenzenesulfonic acid
- IUPAC
- 3-hydroxy-4-methylbenzenesulfonic acid
- English name
- 4-Methyl-3-hydroxybenzenesulfonic acid
- Molecular weight
- 0
Names & synonyms
3-hydroxy-4-methylbenzenesulfonic acido-Cresol-5-sulfonic acid7134-03-4p-Toluenesulfonic acid, 3-hydroxyBenzenesulfonic acid, 3-hydroxy-4-methyl-X8A174030UUNII-X8A174030UDTXSID20500416RefChem:94166DTXCID10451226o-Kresol-5-sulfonsaure3-Hydroxy-4-methylbenzene-1-sulfonic acid
Show more names
o-Cresol-5-sulfonic acid sodium salt4-Methyl-3-hydroxybenzenesulfonic acid
SCHEMBL563388SCHEMBL5155863SCHEMBL91679033-hydroxy-4-methyl-benzenesulfonic acidQ27293683
Database identifiers
- CAS
7134-03-4- PubChem CID
- 12496992
- DTXSID
DTXSID20500416- UNII
- X8A174030U
- Nikkaji
- J163.790H
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 83 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- FDA UNII
- 8 A174030U · X8A174030U
Related reactions
1 records
Compound notes
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