chempirical

5-Chlorooctafluoropentanoyl chloride

C5Cl2F8OCAS 3110-03-0298.94 g/mol

Open in Covalent MOL file
OFFClFFFFFFCl
Acyl halideAlkyl halide

Properties

Molecular formula
C5Cl2F8O
Molar mass
298.94 g/mol
Exact mass
297.9198 Da
logP
3.49Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
3110-03-0
SMILES
C(=O)(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)Cl
InChIKey
FUWJMSXDKGZFFT-UHFFFAOYSA-N
InChI
InChI=1S/C5Cl2F8O/c6-1(16)2(8,9)3(10,11)4(12,13)5(7,14)15

Weigh it out

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Work with 5-Chlorooctafluoropentanoyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2,3,3,4,4-Hexafluoropentanedioyl dichloride678-77-368 % similar Perfluorooctanoyl chloride335-64-862 % similar Perfluorononanoyl chloride52447-23-162 % similar Heptafluorobutyryl chloride375-16-661 % similar 2,2,3,3-Tetrafluorobutanedioyl dichloride356-15-056 % similar 11H-Perfluoroundecanoyl chloride2248-93-353 % similar 7H-Dodecafluoroheptanoyl chloride41405-35-053 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluorononanoyl chloride423-95-053 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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