1,3-Diisopropenylbenzene

C₁₂H₁₄CAS 3748-13-8158.24 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₄
Molar mass: 158.24 g/mol
Exact mass: 158.1096 Da
Boiling point: 102 °C (at 20 Torr)
logP: 3.75Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Identifiers

CAS number

3748-13-8

SMILES

C=C(C)c1cccc(C(=C)C)c1

InChIKey

IBVPVTPPYGGAEL-UHFFFAOYSA-N

InChI

InChI=1S/C12H14/c1-9(2)11-6-5-7-12(8-11)10(3)4/h5-8H,1,3H2,2,4H3

Weigh it out

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

Names and synonyms

7 names

Benzene, 1,3-bis(1-methylethenyl)-
Benzene, m-diisopropenyl-
1,3-Bis(1-methylethenyl)benzene
m-Diisopropenylbenzene
m-Bis(1-methylvinyl)benzene
1,3-Bis(1-methylvinyl)benzene
1,3-Bis(prop-1-en-2-yl)benzene

Work with 1,3-Diisopropenylbenzene

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

Alpha-methylstyrene98-83-968 % similar 1-Chloro-4-(1-methylethenyl)benzene1712-70-554 % similar P-Cymenene1195-32-050 % similar 1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene2094-99-750 % similar 1-Fluoro-4-(1-methylethenyl)benzene350-40-348 % similar 4-Isopropenylphenol4286-23-148 % similar 1,3-Diacetylbenzene6781-42-646 % similar Dimethyl isophthalate1459-93-437 % similar

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

Same formula

1-Hexyn-1-ylbenzene1129-65-3 1-Phenylcyclohexene771-98-2 Styrene-butadiene9003-55-8

Elsewhere

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