Methyl 2,2,3,3-tetrafluoro-3-methoxypropanoate

C5H6F4O3CAS 755-73-7190.09 g/mol

Open in Covalent MOL file
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Alkyl halideEsterEther

Properties

Molecular formula
C5H6F4O3
Molar mass
190.09 g/mol
Exact mass
190.0253 Da
Boiling point
66–71 °C (at 49 Torr)
logP
1.03Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

Warning
Flammable (GHS02)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

Identifiers

CAS number
755-73-7
SMILES
COC(=O)C(F)(F)C(F)(F)OC
InChIKey
NDNOUXQCMAHOSA-UHFFFAOYSA-N
InChI
InChI=1S/C5H6F4O3/c1-11-3(10)4(6,7)5(8,9)12-2/h1-2H3

Weigh it out

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Names and synonyms

5 names
  • Propanoic acid, 2,2,3,3-tetrafluoro-3-methoxy-, methyl ester
  • Propionic acid, 2,2,3,3-tetrafluoro-3-methoxy-, methyl ester
  • Methyl 3-methoxyperfluoropropionate
  • Methyl 3-methoxytetrafluoropropionate
  • Methyl 2,2,3,3-tetrafluoro-3-methoxypropionate

Work with Methyl 2,2,3,3-tetrafluoro-3-methoxypropanoate

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

Dimethyl tetrafluorosuccinate356-36-568 % similar Dimethyl hexafluoroglutarate1513-62-861 % similar Dimethyl perfluorohexanedioate3107-98-061 % similar Methyl 2,2,3,3,3-pentafluoropropanoate378-75-661 % similar Dimethyl dodecafluorosuberate2062-20-659 % similar Dimethyl perfluoroazelate22116-90-159 % similar Dimethyl perfluorosebacate4590-24-359 % similar Dimethyl perfluoro-1,10-decanedicarboxylate84750-88-959 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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