1-Ethyl-4-fluorobenzene

C₈H₉FCAS 459-47-2124.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₉F
Molar mass: 124.16 g/mol
Exact mass: 124.0688 Da
Density: 0.994 g/mL (at 0 °C)
Boiling point: 141 °C
logP: 2.39Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

459-47-2

SMILES

CCc1ccc(F)cc1

InChIKey

BLDNWXVISIXWKZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H9F/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H3

Weigh it out

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

Names and synonyms

5 names

Benzene, 1-ethyl-4-fluoro-
p-Fluoroethylbenzene
4-Fluoroethylbenzene
4-Ethylfluorobenzene
1-Fluoro-4-ethylbenzene

Work with 1-Ethyl-4-fluorobenzene

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

1,4-Diethylbenzene105-05-567 % similar 1,1′-Methylenebis[4-fluorobenzene]457-68-157 % similar 1-Ethyl-3,5-difluorobenzene117358-52-857 % similar 4-Ethylbenzyl chloride1467-05-657 % similar 1-Fluoro-4-pentylbenzene28593-14-854 % similar 4-Fluorobenzyl chloride352-11-452 % similar 4-Ethyltoluene622-96-852 % similar Ethylbenzene100-41-450 % similar

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

Same formula

3-Fluoro-O-xylene443-82-3 2-Fluoro-1,3-dimethylbenzene443-88-9 4-Fluoro-1,2-dimethylbenzene452-64-2

Elsewhere

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