Basic information
- Standard SMILES
Cc1c(O)cc(C(C)C)cc1O- InChIKey
DXPQSMYASPEWEK-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
Names & identifiers
- Preferred name
- Cymorcin
- IUPAC
- 2-methyl-5-propan-2-ylbenzene-1,3-diol
Names & synonyms
Cymorcin4389-62-25-isopropyl-2-methylbenzene-1,3-diol3,5-dihydroxycymeneSCHEMBL1494320MFCD247142255-isopropyl-2-methyl-benzene-1,3-diol2-METHYL-5-(PROPAN-2-YL)BENZENE-1,3-DIOL(WXG01328)
Database identifiers
- PubChem CID
- 23345336
- Nikkaji
- J2.263.666I
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 133
Related reactions
8 records
Compound notes
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