Basic information
- Standard SMILES
COc1cccc(OC)c1/C=C/C=O- InChIKey
IVYUWTPPGFCIMY-SNAWJCMRSA-N- Molecular formula
- C11H12O3
- Average molar mass
- 192.21 g/mol
Names & identifiers
- Preferred name
- (2E)-3-(2,6-dimethoxyphenyl)acrylaldehyde
- IUPAC
- (E)-3-(2,6-dimethoxyphenyl)prop-2-enal
Names & synonyms
SCHEMBL544418SCHEMBL7347811IVYUWTPPGFCIMY-SNAWJCMRSA-NSY415962(E)-3-(2,6-Dimethoxyphenyl)acrylaldehyde(2E)-3-(2,6-dimethoxyphenyl)acrylaldehydePK04_181204EN300-1871668
Database identifiers
- PubChem CID
- 23928193
- Nikkaji
- J1.032.064J、J2.372.296H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 189
Related reactions
4 records
Compound notes
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