Basic information
- CAS
32786-65-5- Standard SMILES
CC(C)N(C)CC(F)(F)C(F)Cl- InChIKey
OXQLRPYKXWHZDU-UHFFFAOYSA-N- Molecular formula
- C7H13ClF3N
- Average molar mass
- 203.63 g/mol
- Monoisotopic mass
- 203.0688616
Names & identifiers
- Preferred name
- 3-chloro-2,2,3-trifluoro-N-methyl-N-propan-2-ylpropan-1-amine
- IUPAC
- 3-chloro-2,2,3-trifluoro-N-methyl-N-propan-2-ylpropan-1-amine
- English name
- 3-Chloro-2,2,3-trifluoro-N-methyl-N-(1-methylethyl)-1-propanamine
- Molecular formula
- C7H13ClF3N
- Molecular weight
- 203.63
Names & synonyms
32786-65-53-chloro-2,2,3-trifluoro-N-methyl-N-propan-2-ylpropan-1-amineDTXSID80345466RefChem:278096DTXCID702965393-Chloro-2,2,3-trifluoro-N-isopropyl-N-methyl-1-propanaminePropylamine, 3-chloro-2,2,3-trifluoro-N-isopropyl-N-methyl-OXQLRPYKXWHZDU-UHFFFAOYSA-N1-Propanamine, 3-chloro-2,2,3-trifluoro-N-methyl-N-(1-methylethyl)-3-Chloro-2,2,3-trifluoro-N-methyl-N-(1-methylethyl)-1-propanamine3-Chloro-2,2,3-trifluoro-N-isopropyl-N-methyl-1-propanamine #3-Chloro-2,2,3-trifluoro-N-methyl-N-(propan-2-yl)propan-1-amine
Database identifiers
- CAS
32786-65-5- PubChem CID
- 604646
- DTXSID
DTXSID80345466- Nikkaji
- J109.507B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 141
Physicochemical properties
- Boiling point
- 160.1 · 160.1±40.0 °C(Predicted)
- Density
- 1.132 · 1.132±0.06 g/cm3(Predicted)
- pka
- 5.43 · 5.43±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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