Hexafluoro-2-butyne
Properties
- Molecular formula
- C4F6
- Molar mass
- 162.03 g/mol
- Exact mass
- 161.9904 Da
- Melting point
- −117.4 °C
- Boiling point
- −24.6 °C
- logP
- 2.11Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Identifiers
CAS number
692-50-2SMILES
FC(F)(F)C#CC(F)(F)FInChIKey
WBCLXFIDEDJGCC-UHFFFAOYSA-NInChI
InChI=1S/C4F6/c5-3(6,7)1-2-4(8,9)10Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 2-Butyne, 1,1,1,4,4,4-hexafluoro-
- 2-Butyne, hexafluoro-
- 1,1,1,4,4,4-Hexafluoro-2-butyne
- Perfluoro-2-butyne
- Bis(trifluoromethyl)acetylene
Work with Hexafluoro-2-butyne
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
Trifluoroacetonitrile353-85-540 % similar
3,3,3-Trifluoropropyne661-54-140 % similar
2,2,2-Trifluoroethan-1,1-D2-ol-D77253-67-940 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds