Basic information
- CAS
34581-41-4- Standard SMILES
C=C=C(C)Cl- InChIKey
CUJKALJDXJTCJX-UHFFFAOYSA-N- Molecular formula
- C4H5Cl
- Average molar mass
- 88.53 g/mol
- Monoisotopic mass
- 88.0079779
Names & identifiers
- Preferred name
- 3-Chloro-1,2-butadiene
- IUPAC
- 3-chlorobuta-1,2-diene
Names & synonyms
3-CHLORO-1,2-BUTADIENE34581-41-4SCHEMBL875275
Database identifiers
- CAS
34581-41-4- PubChem CID
- 36859
- Nikkaji
- J1.617.975B
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 67.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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