Basic information
- Standard SMILES
COC(=O)c1cc(OC)cc2cc(C)oc12- InChIKey
OSYUEZJDIKTUSO-UHFFFAOYSA-N- Molecular formula
- C12H12O4
- Average molar mass
- 220.22 g/mol
Names & identifiers
- Preferred name
- 5-Methoxy-2-methyl-benzofuran-7-carboxylic acid methyl ester
- IUPAC
- methyl 5-methoxy-2-methyl-1-benzofuran-7-carboxylate
Names & synonyms
955885-00-4SCHEMBL642695OSYUEZJDIKTUSO-UHFFFAOYSA-NDB-402796Methyl 5-methoxy-2-methyl-7-benzofurancarboxylatemethyl 5-methoxy-2-methyl-1-benzofuran-7-carboxylate5-Methoxy-2-methyl-benzofuran-7-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 59560465
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 266
Related reactions
5 records
Compound notes
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