chempirical

3,9-Di-3-cyclohexen-1-yl-2,4,8,10-tetraoxaspiro[5.5]undecane

C19H28O4CAS 6600-31-3320.43 g/mol

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OOOO
AcetalAlkeneEther

Properties

Molecular formula
C19H28O4
Molar mass
320.43 g/mol
Exact mass
320.1988 Da
logP
3.43Crippen estimate
Polar surface area
36.9 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
6600-31-3
SMILES
C1CC(CC=C1)C2OCC3(CO2)COC(OC3)C4CCC=CC4
InChIKey
WKTJXDHLMJKSGI-UHFFFAOYSA-N
InChI
InChI=1S/C19H28O4/c1-3-7-15(8-4-1)17-20-11-19(12-21-17)13-22-18(23-14-19)16-9-5-2-6-10-16/h1-3,5,15-18H,4,6-14H2

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Names and synonyms

14 names · show all
  • 3,9-Di(cyclohex-3-en-1-yl)-2,4,8,10-tetraoxaspiro[5.5]undecane
  • 3,9-Dicyclohex-3-enyl-2,4,8,10-tetraoxaspiro[5.5]undecane
  • Bis(delta-tetrahydrobenzylidene)pentaerythritol
  • Bis(.delta.-tetrahydrobenzylidene)pentaerythritol
  • 2,4,8,10-Tetraoxaspiro(5.5)undecane, 3,9-di-3-cyclohexen-1-yl-
  • 2,4,8,10-Tetraoxaspiro[5.5]undecane, 3,9-di-3-cyclohexen-1-yl-
  • 2,4,8,10-Tetraoxaspiro(5.5)undecane, 3,9-di(3-cyclohexenyl)-
  • 3,9-Di-(3-cyclohexenyl)-2,4,8,10-tetraoxaspiro(5,5)undecane
  • 3,9-Di-3-cyclohexen-1-yl-2,4,8,10-tetraoxaspiro(5.5)undecane
  • 3,9-Dicyclohex-3-enyl-2,4,8,10-tetraoxaspiro(5.5)undecane
  • 3,9-Di(3-cyclohexenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane
  • 2,8,10-Tetraoxaspiro[5.5]undecane, 3,9-di(3-cyclohexenyl)-
  • 39-Di(cyclohex-3-en-1-yl)-24810-tetraoxaspiro[5.5]undecane
  • 2,8,10-Tetraoxaspiro[5.5]undecane, 3,9-di-3-cyclohexen-1-yl-

Work with 3,9-Di-3-cyclohexen-1-yl-2,4,8,10-tetraoxaspiro[5.5]undecane

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

4-Methylcyclohexene591-47-932 % similar 3,9-Divinyl-2,4,8,10-tetraoxaspiro[5.5]undecane78-19-331 % similar 9-Oxabicyclo[6.1.0]non-4-ene637-90-131 % similar 4-Vinylcyclohexene100-40-330 % similar Tetrahydrobenzaldehyde100-50-530 % similar 3-Cyclohexene-1-methanol1679-51-230 % similar

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

Elsewhere

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