Basic information
- CAS
3598-31-0- Standard SMILES
Cc1cc(O)c(O)cc1-c1cc(O)c(O)cc1C- InChIKey
XYSDSCUWKAPQBQ-UHFFFAOYSA-N- Molecular formula
- C14H14O4
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.08920892
Names & identifiers
- Preferred name
- 6,6'-Dimethyl(1,1'-biphenyl)-3,3',4,4'-tetraol
- IUPAC
- 4-(4,5-dihydroxy-2-methylphenyl)-5-methylbenzene-1,2-diol
- English name
- 6,6'-dimethyl[1,1'-biphenyl]-3,3',4,4'-tetraol
- Molecular formula
- C14H14O4
- Molecular weight
- 246.25856
Names & synonyms
3598-31-06,6'-Dimethyl(1,1'-biphenyl)-3,3',4,4'-tetraolEINECS 222-747-3DTXSID50189536XYSDSCUWKAPQBQ-UHFFFAOYSA-NNS000299626,6'-Dimethyl[1,1'-biphenyl]-3,3',4,4'-tetrol6,6'-dimethyl[1,1'-biphenyl]-3,3',4,4'-tetraol
Database identifiers
- CAS
3598-31-0- PubChem CID
- 77149
- DTXSID
DTXSID50189536- EC Number
- 222-747-3
- Nikkaji
- J205.526K
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 255
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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