Basic information
- Standard SMILES
CC(C)(O)c1ccccc1CC[C@H](O)c1cccc(COC2CCCCO2)c1- InChIKey
BWOAHEPHJNVOFI-NQCNTLBGSA-N- Molecular formula
- C24H32O4
- Average molar mass
- 384.5 g/mol
Names & identifiers
- Preferred name
- 2-(3-(3-((2-Tetrahydropyranyl)oxymethyl) phenyl)-3(S)-hydroxypropyl)-alpha,alpha-dimethylbenzenemethanol
- IUPAC
- (1S)-3-[2-(2-hydroxypropan-2-yl)phenyl]-1-[3-(oxan-2-yloxymethyl)phenyl]propan-1-ol
Names & synonyms
SCHEMBL8127506BWOAHEPHJNVOFI-NQCNTLBGSA-N1(S)-(3-(((2-Tetrahydropyranyl)oxy)methyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propan-1-ol2-(3-(3-((2-Tetrahydropyranyl)oxymethyl) phenyl)-3(S)-hydroxypropyl)-alpha,alpha-dimethylbenzenemethanol
Database identifiers
- PubChem CID
- 18655246
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 452
Related reactions
2 records
Compound notes
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