chempirical

3-Ethenyl-7-oxabicyclo[4.1.0]heptane

C8H12OCAS 106-86-5124.18 g/mol

Open in Covalent MOL file
O
AlkeneEpoxideEther

Properties

Molecular formula
C8H12O
Molar mass
124.18 g/mol
Exact mass
124.0888 Da
Density
0.9598 g/mL (at 20 °C)
Melting point
below −100 °C
Boiling point
169 °C
logP
1.74Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
106-86-5
SMILES
C=CC1CCC2OC2C1
InChIKey
SLJFKNONPLNAPF-UHFFFAOYSA-N
InChI
InChI=1S/C8H12O/c1-2-6-3-4-7-8(5-6)9-7/h2,6-8H,1,3-5H2

Weigh it out

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

Names and synonyms

27 names · show all
  • 7-Oxabicyclo(4.1.0)heptane, 3-ethenyl-
  • 4-Vinylcyclohexene oxide
  • 7-Oxabicyclo[4.1.0]heptane, 3-ethenyl-
  • 7-Oxabicyclo[4.1.0]heptane, 3-vinyl-
  • Cyclohexane, 1,2-epoxy-4-vinyl-
  • Epoxide 101
  • 1,2-Epoxy-4-vinylcyclohexane
  • Unoxat epoxide 101
  • 4-Vinylcyclohexane 1,2-epoxide
  • 1-Vinyl-3,4-epoxycyclohexane
  • 3-Vinyl-7-oxabicyclo[4.1.0]heptane
  • 3,4-Epoxycyclohexylethylene
  • 4-Vinylcyclohexene monoepoxide
  • 4-Vinylcyclohexane-1-oxide
  • 4-Vinyl-1-cyclohexene-1,2-epoxide
  • Vinyl-3,4-epoxycyclohexane
  • 1-Ethenyl-3-cyclohexene oxide
  • NSC 35409
  • Cyracure VCMX-C
  • 4-Vinylcyclohexene-1,2-oxide
  • 4-Vinylcyclohexene-1,2-epoxide
  • 4-Vinyl-1-cyclohexane 1,2-epoxide
  • 4-Vinyl-1,2-epoxycyclohexane
  • Vinylcyclohexene oxide
  • Vinylcyclohexene monoxide
  • 4-Vinyl 1,2-cyclohexane oxide
  • TTA 11

Work with 3-Ethenyl-7-oxabicyclo[4.1.0]heptane

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

1,2,4-Trivinylcyclohexane2855-27-848 % similar 7,7'-Dioxa-3,3'-bi(bicyclo[4.1.0]heptane)37777-16-544 % similar Vinylcyclohexane695-12-538 % similar Vinyl cyclohexene dioxide106-87-637 % similar 4-Vinylcyclohexene100-40-333 % similar Cyclopentene oxide285-67-633 % similar Cyclohexene oxide286-20-433 % similar (Trans,trans)-4-Ethenyl-4′-propyl-1,1′-bicyclohexyl116020-44-132 % similar

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

Same formula

4,4-Dimethyl-2-cyclohexen-1-one1073-13-8 Bicyclo(3.2.1)octan-3-one14252-05-2 6-Methylhepta-3,5-dien-2-one1604-28-0 2-Butylfuran4466-24-4 9-Oxabicyclo[6.1.0]non-4-ene637-90-1 1-Ethynylcyclohexanol78-27-3 1-Acetylcyclohexene932-66-1 Bicyclo[2.2.1]hept-5-ene-2-methanol95-12-5

Elsewhere

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