4-Fluorostyrene

C₈H₇FCAS 405-99-2122.14 g/mol

Open in Covalent MOL file

Alkene Aryl halide

Properties

Molecular formula: C₈H₇F
Molar mass: 122.14 g/mol
Exact mass: 122.0532 Da
Density: 1.024 g/mL (at 20 °C)
Melting point: −34.5 °C
Boiling point: 29–30 °C (at 4 Torr)
logP: 2.47Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation10.2% of notifiers
H319 Causes serious eye irritation10.2% of notifiers
H335 May cause respiratory irritation10.2% of notifiers

Aggregated from 59 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

405-99-2

SMILES

C=Cc1ccc(F)cc1

InChIKey

JWVTWJNGILGLAT-UHFFFAOYSA-N

InChI

InChI=1S/C8H7F/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H2

Weigh it out

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

Names and synonyms

8 names

Benzene, 1-ethenyl-4-fluoro-
Styrene, p-fluoro-
1-Ethenyl-4-fluorobenzene
p-Fluorostyrene
p-Vinylfluorobenzene
1-Fluoro-4-vinylbenzene
1-Vinyl-4-fluorobenzene
4-Fluoro-1-ethenylbenzene

Work with 4-Fluorostyrene

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

4,4′-Diethenyl-1,1′-biphenyl4433-13-057 % similar P,P'-Divinyl-1,2-diphenylethane48174-52-352 % similar Styrene100-42-550 % similar 4-Chlorostyrene1073-67-250 % similar 4-Aminostyrene1520-21-450 % similar 4-Vinylbenzyl chloride1592-20-750 % similar 4-Vinylbenzaldehyde1791-26-050 % similar 4-Bromostyrene2039-82-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Fluorostyrene350-51-6 1-Ethenyl-2-fluorobenzene394-46-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook