chempirical

2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Heptadecafluorononyl)oxirane

C11H5F17OCAS 38565-53-6476.13 g/mol

Open in Covalent MOL file
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Alkyl halideEpoxideEther

Properties

Molecular formula
C11H5F17O
Molar mass
476.13 g/mol
Exact mass
476.0069 Da
Melting point
76–78 °C
logP
5.78Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
8

Identifiers

CAS number
38565-53-6
SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CC1CO1
InChIKey
HMXSIEIEXLGIET-UHFFFAOYSA-N
InChI
InChI=1S/C11H5F17O/c12-4(13,1-3-2-29-3)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)28/h3H,1-2H2

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

Names and synonyms

13 names · show all
  • Oxirane, 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-
  • Oxirane, (2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-
  • 3-Perfluorooctyl-1,2-epoxypropane
  • (2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Heptadecafluorononyl)oxirane
  • 1,2-Epoxy-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecane
  • 3-(Perfluorooctyl)propylene oxide
  • 3-(2-Perfluoro-n-octyl)-1,2-epoxypropane
  • H 010
  • 3-Perfluorooctyl-1,2-propene oxide
  • 1,2-Epoxy-1H,1H,2H,3H,3H-heptadecafluoroundecane
  • [(Perfluorooctyl)methyl]oxirane
  • 3-Perfluorooctyl-1,2-propeneoxide
  • E 0462

Work with 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Heptadecafluorononyl)oxirane

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-(2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoroheptyl)oxirane38565-52-5100 % similar 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heneicosafluoroundecyl)oxirane38565-54-7100 % similar 2-[2,2,3,3,4,4,5,5,6,6,7,7,8,9,9,9-Hexadecafluoro-8-(trifluoromethyl)nonyl]oxirane41925-33-176 % similar 4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluorononane-1,2-diol107650-06-650 % similar 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoro-1,2-undecanediol94159-84-950 % similar 1H,1H-Perfluorooctanol307-30-247 % similar 1H,1H-Perfluoroundecan-1-ol307-46-047 % similar 2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-1-heptanol375-82-647 % similar

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

Elsewhere

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