1-Fluoro-4-(isopropenyl)benzene

C₉H₉FCAS 350-40-3136.17 g/mol

Open in Covalent MOL file

Alkene Aryl halide

Properties

Molecular formula: C₉H₉F
Molar mass: 136.17 g/mol
Exact mass: 136.0688 Da
Boiling point: 90–94 °C (at 80 Torr)
logP: 2.86Crippen 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 irritation13.3% of notifiers
H319 Causes serious eye irritation13.3% of notifiers
H335 May cause respiratory irritation13.3% of notifiers

Aggregated from 45 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

350-40-3

SMILES

C=C(C)c1ccc(F)cc1

InChIKey

VIXHMBLBLJSGIB-UHFFFAOYSA-N

InChI

InChI=1S/C9H9F/c1-7(2)8-3-5-9(10)6-4-8/h3-6H,1H2,2H3

Weigh it out

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Names and synonyms

11 names

1-Fluoro-4-(1-methylethenyl)benzene
Benzene, 1-fluoro-4-(1-methylethenyl)-
Styrene, p-fluoro-α-methyl-
p-Fluoro-α-methylstyrene
4-Fluoro-α-methylstyrene
1-Fluoro-4-isopropenylbenzene
2-(4-Fluorophenyl)propene
2-(4-Fluorophenyl)-1-propene
4-Fluoro-1-isopropenylbenzene
NSC 74474
1-Fluoro-4-(prop-1-en-2-yl)benzene

Work with 1-Fluoro-4-(isopropenyl)benzene

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

P-Cymenene1195-32-058 % similar Alpha-methylstyrene98-83-956 % similar 1-Chloro-4-(1-methylethenyl)benzene1712-70-556 % similar 4-Isopropenylphenol4286-23-156 % similar 4′-Fluoroacetophenone403-42-950 % similar 1,3-Diisopropenylbenzene3748-13-848 % similar 4,4′-Difluorobenzophenone345-92-644 % similar 1,2-Bis(4-fluorophenyl)-1,2-ethanedione579-39-544 % similar

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

Elsewhere

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