2,2,3,3,4,4-Hexafluoropentanedioyl dichloride
Properties
- Molecular formula
- C5Cl2F6O2
- Molar mass
- 276.94 g/mol
- Exact mass
- 275.9180 Da
- Boiling point
- 110 °C
- logP
- 2.42Crippen estimate
- Polar surface area
- 34.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 4
Hazards
Danger
- H290 May be corrosive to metals11.1% of notifiers
- H302 Harmful if swallowed11.1% of notifiers
- H314 Causes severe skin burns and eye damage88.9% of notifiers
- H318 Causes serious eye damage11.1% of notifiers
- H335 May cause respiratory irritation22.2% of notifiers
Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P390, P403+P233, P405, P406, P501
Identifiers
CAS number
678-77-3SMILES
O=C(Cl)C(F)(F)C(F)(F)C(F)(F)C(=O)ClInChIKey
QOLALWJWCONGMG-UHFFFAOYSA-NInChI
InChI=1S/C5Cl2F6O2/c6-1(14)3(8,9)5(12,13)4(10,11)2(7)15Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Pentanedioyl dichloride, 2,2,3,3,4,4-hexafluoro-
- Glutaryl chloride, hexafluoro-
- Pentanedioyl dichloride, hexafluoro-
- Perfluoroglutaryl chloride
- Hexafluoroglutaryl chloride
- Hexafluoroglutaryl dichloride
- NSC 41888
Work with 2,2,3,3,4,4-Hexafluoropentanedioyl dichloride
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
Heptafluorobutyryl chloride375-16-677 % similar
2,2,3,3-Tetrafluorobutanedioyl dichloride356-15-074 % similar
Perfluorooctanoyl chloride335-64-871 % similar
Perfluorononanoyl chloride52447-23-171 % similar
5-Chlorooctafluoropentanoyl chloride3110-03-068 % similar
2,2,3,3,4,4,5,5-Octafluoropentanoyl chloride376-71-663 % similar
11H-Perfluoroundecanoyl chloride2248-93-359 % similar
7H-Dodecafluoroheptanoyl chloride41405-35-059 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.