Basic information
- CAS
3574-40-1- Standard SMILES
C=C/C(Cl)=C/Cl- InChIKey
CRNSOGJNJXTEQG-ARJAWSKDSA-N- Molecular formula
- C4H4Cl2
- Average molar mass
- 122.98 g/mol
- Monoisotopic mass
- 121.9690055
Names & identifiers
- Preferred name
- 1,3-Butadiene, 1,2-dichloro-
- IUPAC
- (1Z)-1,2-dichlorobuta-1,3-diene
Names & synonyms
1,3-Butadiene, 1,2-dichloro-3574-40-1RefChem:1052733cis-1,2-dichloro-buta-1,3-dieneSCHEMBL7692728
Database identifiers
- CAS
3574-40-1- PubChem CID
- 5463151
- Nikkaji
- J797.870G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 73.6
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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