trans-Propenylbenzene
Properties
- Molecular formula
- C9H10
- Molar mass
- 118.18 g/mol
- Exact mass
- 118.0783 Da
- Density
- 0.91 g/mL
- Melting point
- −29.3 °C
- Boiling point
- 175 °C
- logP
- 2.72Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
- Double bonds
- EE/Z, in SMILES order
Identifiers
CAS number
873-66-5SMILES
C/C=C/c1ccccc1InChIKey
QROGIFZRVHSFLM-QHHAFSJGSA-NInChI
InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
20 names · show all
- Benzene, (1E)-1-propen-1-yl-
- trans-1-Phenyl-1-propene
- (E)-1-Propenylbenzene
- (E)-1-Phenyl-1-propene
- trans-1-Methyl-2-phenylethene
- (E)-1-Phenylpropene
- (E)-β-Methylstyrene
- (E)-Propenylbenzene
- NSC 73958
- (1E)-1-Propenylbenzene
- trans-3-Phenyl-2-propene
- (E)-(1-Propen-1-yl)benzene
- (E)-Prop-1-en-1ylbenzene
- Benzene, propenyl-, (E)-
- Benzene, 1-propenyl-, (E)-
- Benzene, (1E)-1-propenyl-
- (1E)-1-Propen-1-ylbenzene
- trans-1-Propenylbenzene
- trans-β-Methylstyrene
- trans-1-Phenylpropene
Work with trans-Propenylbenzene
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
(E)-Stilbene103-30-065 % similar
(Z)-Stilbene645-49-865 % similar
1,6-Diphenyl-1,3,5-hexatriene1720-32-758 % similar
1,4-Diphenyl-1,3-butadiene886-65-758 % similar
β-Bromostyrene103-64-050 % similar
Anethole104-46-148 % similar
Anethole4180-23-848 % similar
4-Styrylpyridine103-31-148 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds