2,5-Heptadiene, 2-chloro-1,1,1-trifluoro-6-methyl-
Basic information
- CAS
110457-93-7- Standard SMILES
CC(C)=CC/C=C(\Cl)C(F)(F)F- InChIKey
PCKFNFDGDUEJNZ-ALCCZGGFSA-N- Molecular formula
- C8H10ClF3
- Average molar mass
- 198.61 g/mol
- Monoisotopic mass
- 198.0423125
Names & identifiers
- Preferred name
- 2,5-Heptadiene, 2-chloro-1,1,1-trifluoro-6-methyl-
- IUPAC
- (2Z)-2-chloro-1,1,1-trifluoro-6-methylhepta-2,5-diene
Names & synonyms
2,5-Heptadiene, 2-chloro-1,1,1-trifluoro-6-methyl-110457-93-7
Database identifiers
- CAS
110457-93-7- PubChem CID
- 6442893
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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