chempirical

Perfluoromethylcyclopentane

C6F12CAS 1805-22-7300.05 g/mol

Open in Covalent MOL file
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Alkyl halide

Properties

Molecular formula
C6F12
Molar mass
300.05 g/mol
Exact mass
299.9808 Da
Melting point
45 °C
Boiling point
48 °C
logP
3.81Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
1805-22-7
SMILES
FC(F)(F)C1(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIKey
BCNXQFASJTYKDJ-UHFFFAOYSA-N
InChI
InChI=1S/C6F12/c7-1(6(16,17)18)2(8,9)4(12,13)5(14,15)3(1,10)11

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

Names and synonyms

6 names
  • Cyclopentane, 1,1,2,2,3,3,4,4,5-nonafluoro-5-(trifluoromethyl)-
  • Cyclopentane, nonafluoro(trifluoromethyl)-
  • 1,1,2,2,3,3,4,4,5-Nonafluoro-5-(trifluoromethyl)cyclopentane
  • Nonafluoro(trifluoromethyl)cyclopentane
  • (Trifluoromethyl)perfluorocyclopentane
  • Flutec PCI

Work with Perfluoromethylcyclopentane

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

Perfluoromethylcyclohexane355-02-2100 % similar Perfluoro-1,3-dimethylcyclohexane335-27-393 % similar Perfluoro-1,2-dimethylcyclohexane306-98-986 % similar Perfluoro(1-methyldecalin)306-92-380 % similar Perfluorodecalin306-94-569 % similar Perfluoro(2-methylpentane)355-04-469 % similar Perfluoroperhydrophenanthrene306-91-264 % similar 1,1,2,2,3,3,4,4,4A,4B,5,5,6,6,7,7,8,8,8A,9,9,9A-Docosafluorododecahydro-1H-fluorene307-08-460 % similar

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

Same formula

Perfluoro(2-methyl-2-pentene)1584-03-8 Perfluorocyclohexane355-68-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook