1-(2,2-Difluoropropyl)-3-fluorobenzene
Completing data — refresh the page later to see the latest
Basic information
- CAS
62558-07-0- Standard SMILES
CC(F)(F)Cc1cccc(F)c1- InChIKey
GOAQRXYNOJROPS-UHFFFAOYSA-N- Molecular formula
- C9H9F3
- Average molar mass
- 174.16 g/mol
- Monoisotopic mass
- 174.06563477
Names & identifiers
- Preferred name
- 1-(2,2-Difluoropropyl)-3-fluorobenzene
- IUPAC
- 1-(2,2-difluoropropyl)-3-fluorobenzene
- English name
- 1-(2,2-DIFLUOROPROPYL)-3-FLUOROBENZENE
- Molecular formula
- C9H9F3
- Molecular weight
- 174.16
Names & synonyms
1-(2,2-DIFLUOROPROPYL)-3-FLUOROBENZENE62558-07-0Benzene, 1-(2,2-difluoropropyl)-3-fluoro-MFCD11226514DTXSID20672304AKOS0052556741-(2,2-difluoropropyl)-3-fluoro-benzene2,2-Difluor-1-(m-fluorphenyl)propan
Database identifiers
- CAS
62558-07-0- PubChem CID
- 45790486
- DTXSID
DTXSID20672304
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 145
Physicochemical properties
- Boiling point
- 165 · 165.0±40.0 °C(Predicted)
- Density
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…