Basic information
- Standard SMILES
COCc1cc(C)cc(C(C)=O)c1O- InChIKey
LKARHMGTFAUGRN-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
Names & identifiers
- Preferred name
- 2'-Hydroxy-5'-methyl-3'-methoxymethylacetophenone
- IUPAC
- 1-[2-hydroxy-3-(methoxymethyl)-5-methylphenyl]ethanone
Names & synonyms
2'-hydroxy-5'-methyl-3'-methoxymethylacetophenoneSCHEMBL909880LKARHMGTFAUGRN-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 13229232
- Nikkaji
- J813.542H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 203
Related reactions
4 records
Compound notes
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