Perfluorooctanoyl chloride

C8ClF15OCAS 335-64-8432.51 g/mol

Open in Covalent MOL file
OClFFFFFFFFFFFFFFF
Acyl halideAlkyl halide

Properties

Molecular formula
C8ClF15O
Molar mass
432.51 g/mol
Exact mass
431.9398 Da
Melting point
74–75 °C
Boiling point
131 °C
logP
5.13Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
6

Hazards

Danger
Corrosive (GHS05)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501

Identifiers

CAS number
335-64-8
SMILES
O=C(Cl)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
AQQBRCXWZZAFOK-UHFFFAOYSA-N
InChI
InChI=1S/C8ClF15O/c9-1(25)2(10,11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)24

Weigh it out

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

Names and synonyms

9 names
  • Octanoyl chloride, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-
  • Octanoyl chloride, pentadecafluoro-
  • 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoyl chloride
  • Perfluorooctanoic acid chloride
  • Perfluorocaprylic chloride
  • n-Perfluorooctanoyl chloride
  • Pentadecafluorooctanoyl chloride
  • 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoic acid chloride
  • Perfluorooctanoic chloride

Work with Perfluorooctanoyl chloride

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

Perfluorononanoyl chloride52447-23-1100 % similar Heptafluorobutyryl chloride375-16-683 % similar 2,2,3,3,4,4-Hexafluoropentanedioyl dichloride678-77-371 % similar 5-Chlorooctafluoropentanoyl chloride3110-03-062 % similar 11H-Perfluoroundecanoyl chloride2248-93-359 % similar 7H-Dodecafluoroheptanoyl chloride41405-35-059 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluorononanoyl chloride423-95-059 % similar 2,2,3,3-Tetrafluorobutanedioyl dichloride356-15-058 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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