Basic information
- Standard SMILES
Cc1ccc(C(O)c2ccc(C=O)cc2)o1- InChIKey
BSVJRKFCALVJFF-UHFFFAOYSA-N- Molecular formula
- C13H12O3
- Average molar mass
- 216.23 g/mol
Names & identifiers
- Preferred name
- 4-(Hydroxy-(5-methyl-furan-2-yl)-methyl)benzaldehyde
- IUPAC
- 4-[hydroxy-(5-methylfuran-2-yl)methyl]benzaldehyde
Names & synonyms
SCHEMBL509723BSVJRKFCALVJFF-UHFFFAOYSA-N4(Hydroxy-(5-methyl-furan-2-yl)-methyl)-benzaldehyde4-(Hydroxy-(5-methyl-furan-2-yl)-methyl)benzaldehyde4-(Hydroxy-(5-methyl-furan-2-yl)-methyl)-benzaldehyde
Database identifiers
- PubChem CID
- 59255336
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Related reactions
10 records
Compound notes
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