chempirical

Heptafluoroisopropyl acrylate

C6H3F7O2CAS 13057-08-4240.08 g/mol

Open in Covalent MOL file
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AlkeneAlkyl halideEster

Properties

Molecular formula
C6H3F7O2
Molar mass
240.08 g/mol
Exact mass
240.0021 Da
logP
2.51Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
13057-08-4
SMILES
C=CC(=O)OC(F)(C(F)(F)F)C(F)(F)F
InChIKey
JTCVKNUSIGHJRG-UHFFFAOYSA-N
InChI
InChI=1S/C6H3F7O2/c1-2-3(14)15-4(7,5(8,9)10)6(11,12)13/h2H,1H2

Weigh it out

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

Names and synonyms

5 names
  • 2-Propenoic acid, 1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester
  • Acrylic acid, 1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester
  • Acrylic acid, tetrafluoro-1-(trifluoromethyl)ethyl ester
  • 2-Propanol, 1,1,1,2,3,3,3-heptafluoro-, acrylate
  • 1,1,1,2,3,3,3-Heptafluoropropan-2-yl prop-2-enoate

Work with Heptafluoroisopropyl acrylate

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

2,2,3,3,3-Pentafluoropropyl 2-propenoate356-86-552 % similar tert-Butyl acrylate1663-39-450 % similar 2,2,3,3,4,4,4-Heptafluorobutyl 2-propenoate424-64-647 % similar Hexafluoroisopropyl acrylate2160-89-645 % similar 2,2,2-Trifluoroethyl acrylate407-47-645 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctyl 2-propenoate307-98-245 % similar 3,3,4,4,5,5,6,6,6-Nonafluorohexyl 2-propenoate52591-27-244 % similar 1-Adamantylacrylate121601-93-243 % similar

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

Elsewhere

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