3,6-Dimethoxy-4-methylbenzene-1,2-diol
Basic information
- CAS
919289-38-6- Standard SMILES
COc1cc(C)c(OC)c(O)c1O- InChIKey
KNXILUUVCQEGQH-UHFFFAOYSA-N- Molecular formula
- C9H12O4
- Average molar mass
- 184.19 g/mol
- Monoisotopic mass
- 184.07355886
Overview
3,6-Dimethoxy-5-methylbenzene-1,2-diol is a member of phenols and a member of methoxybenzenes.
Names & identifiers
- Preferred name
- 3,6-Dimethoxy-4-methylbenzene-1,2-diol
- IUPAC
- 3,6-dimethoxy-4-methylbenzene-1,2-diol
Names & synonyms
3,6-Dimethoxy-4-methylbenzene-1,2-diol3,6-Dimethoxy-5-methylbenzene-1,2-diol919289-38-6SCHEMBL684134DTXSID50582720CHEBI:203691
Database identifiers
- CAS
919289-38-6- PubChem CID
- 16099554
- DTXSID
DTXSID50582720- ChEBI
CHEBI:203691- Nikkaji
- J3.679.282E
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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