Basic information
- Standard SMILES
COc1cc(C)c(OC)c(OC)c1O- InChIKey
OKIUHFUMJVLVPK-UHFFFAOYSA-N- Molecular formula
- C10H14O4
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.08920892
Names & identifiers
- Preferred name
- 2,3,6-Trimethoxy-4-methylphenol
- IUPAC
- 2,3,6-trimethoxy-4-methylphenol
Names & synonyms
2,3,6-trimethoxy-4-methylphenolSCHEMBL3678118OKIUHFUMJVLVPK-UHFFFAOYSA-N4-methyl-2,3,6-trimethoxyphenol2,3,6-trimethoxy-4-methyl-phenol150626-26-9DB-376038
Database identifiers
- PubChem CID
- 24975596
- Nikkaji
- J3.446.213E
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Related reactions
2 records
Linked notes
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