Alpha-methylstyrene

C₉H₁₀CAS 98-83-9118.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₀
Molar mass: 118.18 g/mol
Exact mass: 118.0783 Da
Density: 0.91 g/mL
Melting point: −23.2 °C
Boiling point: 165.4 °C
Flash point: 83.89 °C (closed cup)
Water solubility: 116 mg/L
logP: 2.72Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Warning

H226 Flammable liquid and vaporFlammable liquids
H319 Causes serious eye irritationSerious eye damage/eye irritation
H335 May cause respiratory irritationSpecific target organ toxicity, single exposure; Respiratory tract irritation
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P273, P280, P303+P361+P353, P304+P340, P305+P351+P338, P319, P337+P317, P370+P378, P391, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

98-83-9

SMILES

C=C(C)c1ccccc1

InChIKey

XYLMUPLGERFSHI-UHFFFAOYSA-N

InChI

InChI=1S/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H3

Weigh it out

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

Names and synonyms

23 names · show all

Benzene, (1-methylethenyl)-
Styrene, α-methyl-
Benzene, isopropenyl-
(1-Methylethenyl)benzene
Isopropenylbenzene
α-Methylstyrene
β-Phenylpropylene
1-Propene, 2-phenyl-
α-Methylstyrol
1-Methyl-1-phenylethylene
1-Phenyl-1-methylethylene
2-Phenylpropene
2-Phenyl-1-propene
2-Phenyl-2-propene
Methylstyrene
1-Methyl-1-phenylethene
1-Methylvinyl benzene
NSC 9400
α-Methylvinylbenzene
2-Phenylpropylene
2-Phenyl-1-propylene
Prop-1-en-2-ylbenzene
K 150 (Styrene)

Work with Alpha-methylstyrene

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

1,3-Diisopropenylbenzene3748-13-868 % similar P-Cymenene1195-32-058 % similar 1-Chloro-4-(1-methylethenyl)benzene1712-70-556 % similar 1-Fluoro-4-(isopropenyl)benzene350-40-356 % similar 4-Isopropenylphenol4286-23-156 % similar 2,3-Diphenylbuta-1,3-diene2548-47-250 % similar 1,1-Diphenylethylene530-48-350 % similar 1-Phenylethanone 2-(1-phenylethylidene)hydrazone729-43-144 % similar

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

Same formula

3-Methylstyrene100-80-1 Phenylpropene300-57-2 Indane496-11-7 2-Methylstyrene611-15-4 4-Vinyltoluene622-97-9 β-Methylstyrene637-50-3 cis-Beta-methylstyrene766-90-5 Phenylcyclopropane873-49-4

Elsewhere

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