4-Hydroxy-5-methoxy[1,1'-biphenyl]-2-carbaldehyde
Basic information
- CAS
69048-74-4- Standard SMILES
COc1cc(-c2ccccc2)c(C=O)cc1O- InChIKey
JEOJJYZGRWBZAW-UHFFFAOYSA-N- Molecular formula
- C14H12O3
- Average molar mass
- 228.24 g/mol
- Monoisotopic mass
- 228.07864424
Names & identifiers
- Preferred name
- 4-Hydroxy-5-methoxy[1,1'-biphenyl]-2-carbaldehyde
- IUPAC
- 5-hydroxy-4-methoxy-2-phenylbenzaldehyde
Names & synonyms
69048-74-4[1,1'-Biphenyl]-2-carboxaldehyde, 4-hydroxy-5-methoxy-4-Hydroxy-5-methoxy[1,1'-biphenyl]-2-carbaldehydeDTXSID70499306AKOS000124359
Database identifiers
- CAS
69048-74-4- PubChem CID
- 12464686
- DTXSID
DTXSID70499306- Nikkaji
- J3.660.873K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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