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Basic information
- CAS
20604-88-0- Standard SMILES
O=CC=CCl- InChIKey
ZSOPPQGHWJVKJB-UHFFFAOYSA-N- Molecular formula
- C3H3ClO
- Average molar mass
- 90.51 g/mol
- Monoisotopic mass
- 89.9872424
Names & identifiers
- Preferred name
- 3-Chloroprop-2-enal
- IUPAC
- 3-chloroprop-2-enal
Names & synonyms
3-chloroprop-2-enal20604-88-02-Propenal, 3-chloro-SCHEMBL532409SCHEMBL1032876SCHEMBL11804910SCHEMBL11804916SCHEMBL282205032-Propenal, 3-chloro- (9CI)DTXSID101314700
Database identifiers
- CAS
20604-88-0- PubChem CID
- 30201
- DTXSID
DTXSID101314700
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 48
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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