Methyl 2-hydroxy-4-methylsalicylate
Basic information
- Standard SMILES
COC(=O)C1C=CC(C)=CC1(O)O- InChIKey
HOJCLTROPQLMMJ-UHFFFAOYSA-N- Molecular formula
- C9H12O4
- Average molar mass
- 184.19 g/mol
Names & identifiers
- Preferred name
- Methyl 2-hydroxy-4-methylsalicylate
- IUPAC
- methyl 6,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate
Names & synonyms
SCHEMBL2968721HOJCLTROPQLMMJ-UHFFFAOYSA-Nmethyl 2-hydroxy-4-methylsalicylate
Database identifiers
- PubChem CID
- 68460751
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 275
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Related reactions
1 records
Compound notes
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