1,1,1-Trifluoropropane

C₃H₅F₃CAS 421-07-898.07 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₅F₃
Molar mass: 98.07 g/mol
Exact mass: 98.0343 Da
Melting point: −148 °C
Boiling point: −13 °C
logP: 1.96Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

421-07-8

SMILES

CCC(F)(F)F

InChIKey

KDWQLICBSFIDRM-UHFFFAOYSA-N

InChI

InChI=1S/C3H5F3/c1-2-3(4,5)6/h2H2,1H3

Weigh it out

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

Names and synonyms

3 names

Propane, 1,1,1-trifluoro-
R 263Fb
HFC 263fb

Work with 1,1,1-Trifluoropropane

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

1,1,1,3,3,3-Hexafluoropropane690-39-140 % similar 2-Methyl-2-butanethiol1679-09-037 % similar 3,3-Dimethylpentane562-49-235 % similar 2,2-Dimethylbutane75-83-235 % similar 1,1,1,2-Tetrafluoroethane811-97-235 % similar 1,1,1,3,3-Pentafluorobutane406-58-635 % similar 1,1′-Oxybis[2,2,2-trifluoroethane]333-36-833 % similar 1,1,1-Trifluoro-2-iodoethane353-83-333 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook