Basic information
- CAS
83682-51-3- Standard SMILES
C=C(CCl)CCC(=C)CCl- InChIKey
QEQHYDPXVQCADF-UHFFFAOYSA-N- Molecular formula
- C8H12Cl2
- Average molar mass
- 179.08 g/mol
- Monoisotopic mass
- 178.0316058
Names & identifiers
- Preferred name
- 2,5-Bis(chloromethyl)-1,5-hexadiene
- IUPAC
- 2,5-bis(chloromethyl)hexa-1,5-diene
Names & synonyms
2,5-BIS(CHLOROMETHYL)-1,5-HEXADIENE83682-51-32,5-bis(chloromethyl)hexa-1,5-dieneDTXSID50232516
Database identifiers
- CAS
83682-51-3- PubChem CID
- 55080
- DTXSID
DTXSID50232516- Nikkaji
- J1.596.136H
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 111
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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