Basic information
- CAS
819-06-7- Standard SMILES
CN(C)CC(F)(F)F- InChIKey
PVSHBYHMVOHXIM-UHFFFAOYSA-N- Molecular formula
- C4H8F3N
- Average molar mass
- 127.11 g/mol
- Monoisotopic mass
- 127.06088375
Names & identifiers
- Preferred name
- Dimethyl(2,2-difluoroethyl)amine
- IUPAC
- 2,2,2-trifluoro-N,N-dimethylethanamine
Names & synonyms
819-06-7Dimethyl(2,2,2-trifluoroethyl)amineDimethyl(2,2-difluoroethyl)amine2,2,2-trifluoro-N,N-dimethylethanamine(CH3)2NCH2CF3CHEMBL612050SCHEMBL9946967SCHEMBL10321646SCHEMBL16295833DTXSID20231450PVSHBYHMVOHXIM-UHFFFAOYSA-NPYDWLBLESBJJSJ-UHFFFAOYSA-N
Show more names
2,2,2-trifluoro-N,N-dimethyl-ethanamineethane, 1-dimethylamino-2,2,2-trifluoro-N,N-dimethyl-(2,2,2-trifluoro-ethyl)amineF099990
Database identifiers
- CAS
819-06-7- PubChem CID
- 136642
- DTXSID
DTXSID20231450- ChEMBL
CHEMBL612050- Nikkaji
- J1.603.430D
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 66.2
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
LogP1.06
Dissociation Constants4.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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