1-Chloro-4-(1-methylethenyl)benzene

C₉H₉ClCAS 1712-70-5152.62 g/mol

Open in Covalent MOL file

Alkene Aryl halide

Properties

Molecular formula: C₉H₉Cl
Molar mass: 152.62 g/mol
Exact mass: 152.0393 Da
Density: 1.075 g/mL (at 20 °C)
Boiling point: 89 °C
logP: 3.37Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

1712-70-5

SMILES

C=C(C)c1ccc(Cl)cc1

InChIKey

WQDGTJOEMPEHHL-UHFFFAOYSA-N

InChI

InChI=1S/C9H9Cl/c1-7(2)8-3-5-9(10)6-4-8/h3-6H,1H2,2H3

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

Names and synonyms

14 names · show all

Benzene, 1-chloro-4-(1-methylethenyl)-
Styrene, p-chloro-α-methyl-
p-Chloro-α-methylstyrene
4-Chloro-α-methylstyrene
2-(p-Chlorophenyl)propene
2-(4-Chlorophenyl)propene
1-Chloro-4-isopropenylbenzene
p-Chloroisopropenylbenzene
α-Methyl-p-chlorostyrene
2-(4-Chlorophenyl)-1-propene
α-Methyl-4-chlorostyrene
4-Isopropenylphenyl chloride
1-Chloro-4-(prop-1-en-2-yl)benzene
4-Isopropenyl-1-chlorobenzene

Work with 1-Chloro-4-(1-methylethenyl)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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

P-Cymenene1195-32-058 % similar Alpha-methylstyrene98-83-956 % similar 1-Fluoro-4-(1-methylethenyl)benzene350-40-356 % similar 4-Isopropenylphenol4286-23-156 % similar 1,3-Diisopropenylbenzene3748-13-854 % similar P-Chloroacetophenone99-91-250 % similar 1-(4-Chlorophenyl)-1,2-propanedione10557-21-845 % similar 4,4′-Dichlorobenzil3457-46-344 % similar

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

Same formula

4-Vinylbenzyl chloride1592-20-7 Cinnamyl chloride2687-12-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook