Basic information
- Standard SMILES
CCCOc1cccc(C=CC(=O)Cl)c1- InChIKey
AYSDOMUMDAUNAE-UHFFFAOYSA-N- Molecular formula
- C12H13ClO2
- Average molar mass
- 224.68 g/mol
- Monoisotopic mass
- 224.0604073
Names & identifiers
- Preferred name
- 3-(3-Propoxyphenyl)prop-2-enoyl chloride
- IUPAC
- 3-(3-propoxyphenyl)prop-2-enoyl chloride
Database identifiers
- PubChem CID
- 53669154
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 226
Related reactions
1 records
Compound notes
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