3,3,4,4,5,5-Hexafluorodihydro-2H-pyran-2,6(3H)-dione

C₅F₆O₃CAS 376-68-1222.04 g/mol

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Acid anhydride Alkyl halide

Properties

Molecular formula: C₅F₆O₃
Molar mass: 222.04 g/mol
Exact mass: 221.9752 Da
Density: 1.7231 g/mL (at 40 °C)
Boiling point: 72 °C
logP: 0.98Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

376-68-1

SMILES

O=C1OC(=O)C(F)(F)C(F)(F)C1(F)F

InChIKey

IHYAGCYJVNHXCT-UHFFFAOYSA-N

InChI

InChI=1S/C5F6O3/c6-3(7)1(12)14-2(13)4(8,9)5(3,10)11

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Names and synonyms

6 names

2H-Pyran-2,6(3H)-dione, 3,3,4,4,5,5-hexafluorodihydro-
Glutaric anhydride, hexafluoro-
Perfluoroglutaric anhydride
Hexafluoroglutaric anhydride
3,3,4,4,5,5-Hexafluorooxane-2,6-dione
2,2,3,3,4,4-Hexafluoropentanedioic anhydride

Work with 3,3,4,4,5,5-Hexafluorodihydro-2H-pyran-2,6(3H)-dione

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

Heptafluorobutyric anhydride336-59-477 % similar 3,3,4,4-Tetrafluorodihydro-2,5-furandione699-30-974 % similar Pentafluoropropionic anhydride356-42-364 % similar 1,5-Diethyl 2,2,3,3,4,4-hexafluoropentanedioate424-40-856 % similar Methyl 2,2,3,3,4,4,4-heptafluorobutanoate356-24-150 % similar Trifluoroacetic anhydride407-25-050 % similar Methyl perfluorotetradecanoate203302-99-247 % similar Methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecanoate307-79-947 % similar

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

Elsewhere

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