Ethyl hexafluoroglutaryl chloride

C₇H₅ClF₆O₃CAS 18381-53-8286.55 g/mol

Open in Covalent MOL file

Acyl halide Alkyl halide Ester

Properties

Molecular formula: C₇H₅ClF₆O₃
Molar mass: 286.55 g/mol
Exact mass: 285.9831 Da
logP: 2.22Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 5

Identifiers

CAS number

18381-53-8

SMILES

CCOC(=O)C(C(C(C(=O)Cl)(F)F)(F)F)(F)F

InChIKey

OLRXGDHRDQKNGW-UHFFFAOYSA-N

InChI

InChI=1S/C7H5ClF6O3/c1-2-17-4(16)6(11,12)7(13,14)5(9,10)3(8)15/h2H2,1H3

Weigh it out

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

Names and synonyms

1 names

4-Carbethoxyhexafluorobutyryl chloride

Work with Ethyl hexafluoroglutaryl 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

1,5-Diethyl 2,2,3,3,4,4-hexafluoropentanedioate424-40-877 % similar Ethyl 2,2,3,3,4,4,4-heptafluorobutanoate356-27-466 % similar 1,4-Diethyl 2,2,3,3-tetrafluorobutanedioate377-71-963 % similar Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoate30377-52-762 % similar Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate3108-24-562 % similar Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate41430-70-062 % similar 2,2,3,3,4,4-Hexafluoropentanedioyl dichloride678-77-358 % similar Ethyl 2,2,3,3,3-pentafluoropropanoate426-65-357 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook