1-Chloro-4,4-dimethyl-2,3-pentadiene
Basic information
- CAS
65388-53-6- Standard SMILES
CC(C)(C)C=C=CCl- InChIKey
ONNHATFAOCHMIL-UHFFFAOYSA-N- Molecular formula
- C7H11Cl
- Average molar mass
- 130.61 g/mol
- Monoisotopic mass
- 130.054928
Names & identifiers
- Preferred name
- 1-Chloro-4,4-dimethyl-2,3-pentadiene
- IUPAC
- 1-chloro-4,4-dimethylpenta-1,2-diene
Names & synonyms
1-Chloro-4,4-dimethyl-2,3-pentadiene65388-53-6DTXSID70215705RefChem:229398DTXCID601381961-chloro-4,4-dimethylpenta-1,2-diene(CH3)3CCH=C=CHCl
Database identifiers
- CAS
65388-53-6- PubChem CID
- 144124
- DTXSID
DTXSID70215705- Nikkaji
- J2.850.853K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 111
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Compound notes
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