chempirical

(E)-Stilbene

C14H12CAS 103-30-0180.25 g/mol

Open in Covalent MOL file
Alkene

Properties

Molecular formula
C14H12
Molar mass
180.25 g/mol
Exact mass
180.0939 Da
Density
0.97 g/mL
Melting point
124 °C
Boiling point
306–307 °C
Water solubility
insoluble
logP
3.86Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, P501

Identifiers

CAS number
103-30-0
SMILES
C(=C/c1ccccc1)c1ccccc1
InChIKey
PJANXHGTPQOBST-VAWYXSNFSA-N
InChI
InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11+

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Names and synonyms

13 names · show all
  • Benzene, 1,1′-(1E)-1,2-ethenediylbis-
  • Stilbene, (E)-
  • Benzene, 1,1′-(1,2-ethenediyl)bis-, (E)-
  • Stilbene, trans-
  • 1,1′-(1E)-1,2-Ethenediylbis[benzene]
  • trans-α,β-Diphenylethylene
  • trans-1,2-Diphenylethylene
  • trans-Stilbene
  • trans-1,2-Diphenylethene
  • (E)-1,2-Diphenylethylene
  • trans-Diphenylethene
  • (E)-1,2-Diphenylethene
  • NSC 2069

Reactions

Work with (E)-Stilbene

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

1,6-Diphenyl-1,3,5-hexatriene1720-32-773 % similar 1,4-Diphenyl-1,3-butadiene886-65-773 % similar 4-Styrylpyridine103-31-167 % similar 4,4′-Diphenylstilbene2039-68-165 % similar β-Methylstyrene637-50-365 % similar trans-Propenylbenzene873-66-565 % similar trans-4-Hydroxystilbene6554-98-963 % similar 4-Aminostilbene834-24-263 % similar

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

Same formula

4-Ethenyl-1,1′-biphenyl2350-89-2 9-Methylfluorene2523-37-7 1,1-Diphenylethylene530-48-3 9,10-Dihydroanthracene613-31-0 (Z)-Stilbene645-49-8 9,10-Dihydrophenanthrene776-35-2

Elsewhere

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