2-Vinylcrotonaldehyde
Basic information
- CAS
20521-42-0- Standard SMILES
C=C/C(C=O)=C\C- InChIKey
XOBGIOGZLQNHMM-GQCTYLIASA-N- Molecular formula
- C6H8O
- Average molar mass
- 96.13 g/mol
- Monoisotopic mass
- 96.05751487
Names & identifiers
- Preferred name
- 2-Vinylcrotonaldehyde
- IUPAC
- (E)-2-ethenylbut-2-enal
Names & synonyms
2-Vinylbut-2-enal2-VinylcrotonaldehydeEINECS 243-859-9SCHEMBL6441565
Database identifiers
- CAS
20521-42-0- PubChem CID
- 6433764
- Nikkaji
- J35.927K
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 101
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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