2-Chloropentafluoro-1,3-butadiene
Properties
- Molecular formula
- C4ClF5
- Molar mass
- 178.49 g/mol
- Exact mass
- 177.9609 Da
- Boiling point
- 37 °C
- logP
- 3.41Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
Identifiers
CAS number
392-42-7SMILES
FC(F)=C(F)C(Cl)=C(F)FInChIKey
ZQZMAJGEFXFVCR-UHFFFAOYSA-NInChI
InChI=1S/C4ClF5/c5-1(3(7)8)2(6)4(9)10Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- 1,3-Butadiene, 2-chloro-1,1,3,4,4-pentafluoro-
- 1,3-Butadiene, 2-chloropentafluoro-
- 2-Chloro-1,1,3,4,4-pentafluoro-1,3-butadiene
Work with 2-Chloropentafluoro-1,3-butadiene
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
Hexafluorobutadiene685-63-250 % similar
Polychlorotrifluoroethylene9002-83-935 % similar
Tetrafluoroethylene116-14-331 % similar
Polytetrafluoroethylene9002-84-031 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds