chempirical

1,1,1-Trifluoro-2-propanamine

C3H6F3NCAS 421-49-8113.08 g/mol

Open in Covalent MOL file
H2NFFF
Alkyl halidePrimary amine

Properties

Molecular formula
C3H6F3N
Molar mass
113.08 g/mol
Exact mass
113.0452 Da
Boiling point
46–47 °C
logP
0.90Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
421-49-8
SMILES
CC(N)C(F)(F)F
InChIKey
SNMLKBMPULDPTA-UHFFFAOYSA-N
InChI
InChI=1S/C3H6F3N/c1-2(7)3(4,5)6/h2H,7H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 2-Propanamine, 1,1,1-trifluoro-
  • Ethylamine, 2,2,2-trifluoro-1-methyl-
  • 2,2,2-Trifluoro-1-methylethylamine
  • 1,1,1-Trifluoroprop-2-ylamine
  • 1,1,1-Trifluoro-2-aminopropane
  • 2-Amino-1,1,1-trifluoropropane

Work with 1,1,1-Trifluoro-2-propanamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(S)-1,1,1-Trifluoroisopropylamine hydrochloride125353-44-883 % similar (+)-2-Amino-3,3-dimethylbutane22526-47-245 % similar 2-Amino-3,3-dimethylbutane3850-30-445 % similar 1,1,1-Trifluoro-2-propanol374-01-638 % similar Rimantadine13392-28-436 % similar Rimantadine hydrochloride1501-84-432 % similar 4-(Trifluoromethyl)cyclohexanamine58665-70-632 % similar Isoflurothyl13171-18-130 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook