Basic information
- Standard SMILES
COc1ccc(CCCC=O)cc1- InChIKey
CIVSDAZZSGAFFX-UHFFFAOYSA-N- Molecular formula
- C11H14O2
- Average molar mass
- 178.23 g/mol
Names & identifiers
- Preferred name
- 4-(4-Methoxyphenyl)butanal
- IUPAC
- 4-(4-methoxyphenyl)butanal
Names & synonyms
4-(4-methoxyphenyl)butanal56047-51-94-(4-Methoxyphenyl)butyraldehydeMFCD11553602SCHEMBL1272898SCHEMBL12729004(4-Methoxyphenyl)butyraldehydeSCHEMBL11834762CIVSDAZZSGAFFX-UHFFFAOYSA-N4-(4-methoxyphenyl)-butyraldehyde4-(4-Methoxy-phenyl)-butyraldehydeAKOS006324775
Show more names
DA-04872CS-0302976EN300-1850138F714062
Database identifiers
- PubChem CID
- 10487555
- Nikkaji
- J788.062F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 137
Related reactions
3 records
Compound notes
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