Basic information
- Standard SMILES
CC[C@H](C)COCCCc1ccc(O)cc1- InChIKey
MXGXZPXUKSUBJR-LBPRGKRZSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
Names & identifiers
- Preferred name
- (+)-4-[3-{2(S)-methylbutoxy}propyl]phenol
- IUPAC
- 4-[3-[(2S)-2-methylbutoxy]propyl]phenol
Names & synonyms
SCHEMBL9259724MXGXZPXUKSUBJR-LBPRGKRZSA-N(+)-4-[3-{2(S)-methylbutoxy}propyl]phenol
Database identifiers
- PubChem CID
- 22844682
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 162
Related reactions
3 records
Compound notes
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