1-(2,2-Difluoroethyl)-3-(trifluoromethyl)benzene
Basic information
- CAS
50562-17-9- Standard SMILES
FC(F)Cc1cccc(C(F)(F)F)c1- InChIKey
HWYIDAUABKEGRG-UHFFFAOYSA-N- Molecular formula
- C9H7F5
- Average molar mass
- 210.14 g/mol
- Monoisotopic mass
- 210.04679103
Names & identifiers
- Preferred name
- 1-(2,2-Difluoroethyl)-3-(trifluoromethyl)benzene
- IUPAC
- 1-(2,2-difluoroethyl)-3-(trifluoromethyl)benzene
Names & synonyms
1-(2,2-difluoroethyl)-3-(trifluoromethyl)benzene50562-17-9DTXSID10301297RefChem:222726DTXCID50252431NSC142242NSC-142242DS-007928
Database identifiers
- CAS
50562-17-9- PubChem CID
- 285377
- DTXSID
DTXSID10301297
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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