Basic information
- Standard SMILES
Cc1ccc([C@H](C)CO)c(O)c1- InChIKey
CLJPRXFHCRIUKW-MRVPVSSYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Overview
2-[(2S)-1-hydroxypropan-2-yl]-5-methylphenol has been reported in Inula salsoloides, Eupatorium fortunei, and other organisms with data available.
Names & identifiers
- Preferred name
- 2-[(2S)-1-hydroxypropan-2-yl]-5-methylphenol
- IUPAC
- 2-[(2S)-1-hydroxypropan-2-yl]-5-methylphenol
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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