Basic information
- Standard SMILES
CCOc1cc(C=O)cc(OCC)c1Cl- InChIKey
CVGUZCQQVNVWQO-UHFFFAOYSA-N- Molecular formula
- C11H13ClO3
- Average molar mass
- 228.67 g/mol
- Monoisotopic mass
- 228.055322
Names & identifiers
- Preferred name
- 4-Chloro-3,5-diethoxybenzaldehyde
- IUPAC
- 4-chloro-3,5-diethoxybenzaldehyde
Names & synonyms
4-chloro-3,5-diethoxybenzaldehyde916344-45-14-chloro-3,5-diethoxy-benzaldehydeSCHEMBL1121517CVGUZCQQVNVWQO-UHFFFAOYSA-NMFCD24387042AS-78535DB-195534D93588F844157
Database identifiers
- PubChem CID
- 59210375
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 182
Related reactions
11 records
Compound notes
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