1,2-Dichloro-3,3,4,4,5,5,6,6-octafluorocyclohexene
Properties
- Molecular formula
- C6Cl2F8
- Molar mass
- 294.95 g/mol
- Exact mass
- 293.9249 Da
- Density
- 1.719 g/mL (at 25 °C)
- Melting point
- −70 °C
- Boiling point
- 113 °C
- logP
- 4.23Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Danger
- H330 Fatal if inhaled100% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P271, P284, P304+P340, P316, P320, P403+P233, P405, P501
Identifiers
CAS number
336-19-6SMILES
FC1(F)C(Cl)=C(Cl)C(F)(F)C(F)(F)C1(F)FInChIKey
BICOGOBTBGYGFA-UHFFFAOYSA-NInChI
InChI=1S/C6Cl2F8/c7-1-2(8)4(11,12)6(15,16)5(13,14)3(1,9)10Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Cyclohexene, 1,2-dichloro-3,3,4,4,5,5,6,6-octafluoro-
- Cyclohexene, 1,2-dichlorooctafluoro-
- 1,2-Dichlorooctafluorocyclohexene
- 1,2-Dichloroperfluorocyclohexene
- 1,2-Dichloro-3,3,4,4,5,5,6,6-octafluoro-1-cyclohexene
Work with 1,2-Dichloro-3,3,4,4,5,5,6,6-octafluorocyclohexene
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
1,2-Dichloro-3,3,4,4,5,5-hexafluorocyclopentene706-79-688 % similar
1,2-Dichlorotetrafluorocyclobutene-1377-93-569 % similar
2,2,3,3,4,4-Hexafluoropentanedioyl dichloride678-77-343 % similar
2,3-Dichloro-1,1,1,4,4,4-hexafluoro-2-butene303-04-842 % similar
Perfluorooctanoyl chloride335-64-841 % similar
Perfluorononanoyl chloride52447-23-141 % similar
5-Chlorooctafluoropentanoyl chloride3110-03-039 % similar
Heptafluorobutyryl chloride375-16-638 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.