Ethyl 2-fluoropropionate

C₅H₉FO₂CAS 349-43-9120.12 g/mol

Open in Covalent MOL file

Alkyl halide Ester

Properties

Molecular formula: C₅H₉FO₂
Molar mass: 120.12 g/mol
Exact mass: 120.0587 Da
logP: 0.91Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

349-43-9

SMILES

CCOC(=O)C(C)F

InChIKey

ODMITNOQNBVSQG-UHFFFAOYSA-N

InChI

InChI=1S/C5H9FO2/c1-3-8-5(7)4(2)6/h4H,3H2,1-2H3

Weigh it out

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

Work with Ethyl 2-fluoropropionate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Ethyl 2-fluoropropionate127306-59-6

Similar compounds

Ethyl difluoroacetate454-31-963 % similar Diethyl fluoromalonate685-88-163 % similar Diethyl methylmalonate609-08-559 % similar Ethyl isobutyrate97-62-159 % similar Ethyl chlorofluoroacetate401-56-959 % similar 1,1,1-Triethyl methanetricarboxylate6279-86-358 % similar Ethyl bromofluoroacetate401-55-857 % similar 1,3-Diethyl 2-(1-methylethyl)propanedioate759-36-455 % similar

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

Same formula

Methyl 2-fluoroisobutyrate338-76-1 4-Fluorobutyric acid methyl ester406-20-2

Elsewhere

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