Ethyl 2,2-difluoropent-4-enoate

C₇H₁₀F₂O₂CAS 110482-96-7164.15 g/mol

Open in Covalent MOL file

Alkene Alkyl halide Ester

Properties

Molecular formula: C₇H₁₀F₂O₂
Molar mass: 164.15 g/mol
Exact mass: 164.0649 Da
logP: 1.76Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

110482-96-7

SMILES

CCOC(=O)C(CC=C)(F)F

InChIKey

YWORETBGSIWDRB-UHFFFAOYSA-N

InChI

InChI=1S/C7H10F2O2/c1-3-5-7(8,9)6(10)11-4-2/h3H,1,4-5H2,2H3

Weigh it out

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

Work with Ethyl 2,2-difluoropent-4-enoate

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

Diethyl diallylmalonate3195-24-267 % similar 1,4-Diethyl 2,2,3,3-tetrafluorobutanedioate377-71-952 % similar Ethyl trifluoroacetate383-63-152 % similar Ethyl 2-chloro-2,2-difluoroacetate383-62-051 % similar 1,5-Diethyl 2,2,3,3,4,4-hexafluoropentanedioate424-40-847 % similar Ethyl 2,2,3,3,3-pentafluoropropanoate426-65-347 % similar Ethyl bromodifluoroacetate667-27-647 % similar Diethylmalonic acid diethyl ester77-25-847 % similar

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

Same formula

4,4-Difluorocyclohexanecarboxylic acid122665-97-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook