chempirical

1,1-Bis(tert-butylperoxy)cyclohexane

C14H28O4CAS 3006-86-8260.37 g/mol

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Peroxide

Properties

Molecular formula
C14H28O4
Molar mass
260.37 g/mol
Exact mass
260.1988 Da
Density
0.941 g/mL (at 20 °C)
Boiling point
52–54 °C (at 0.15 Torr)
logP
4.14Crippen estimate
Polar surface area
36.9 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Identifiers

CAS number
3006-86-8
SMILES
CC(C)(C)OOC1(OOC(C)(C)C)CCCCC1
InChIKey
HSLFISVKRDQEBY-UHFFFAOYSA-N
InChI
InChI=1S/C14H28O4/c1-12(2,3)15-17-14(10-8-7-9-11-14)18-16-13(4,5)6/h7-11H2,1-6H3

Weigh it out

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

Names and synonyms

43 names · show all
  • Peroxide, 1,1′-cyclohexylidenebis[2-(1,1-dimethylethyl)
  • Peroxide, cyclohexylidenebis[tert-butyl
  • Peroxide, cyclohexylidenebis[(1,1-dimethylethyl)
  • 1,1′-Cyclohexylidenebis[2-(1,1-dimethylethyl) peroxide]
  • Lupersol 331-80B
  • 1,1-Di(tert-Butylperoxy)cyclohexane
  • Chaloxyd P 1250AL
  • Trigonox 22B50
  • Lupersol 331
  • Lupersol 321
  • Trigonox 22B75
  • 1,1-Bis(tert-butyldioxy)cyclohexane
  • USP 400
  • Luperco 331XL
  • Trigonox 22
  • 1,1-Di(t-butylperoxy)cyclohexane
  • Perhexa C
  • Luperox 331M50
  • CH 50-AL
  • USP 400P
  • Trigonox 22C50
  • Luperox 331
  • L 331
  • DP 275B
  • Perhexa C 40
  • Trigonox 22E70
  • Luperox 331M80
  • Perhexa CS
  • Perhexa C 75
  • Trigonox 22E50
  • Peroxan PK 122W
  • Tx 22E50
  • Luperox 331M70
  • CH 80
  • CH 80 (vulcanizer)
  • 1,1-Bis(1,1-dimethylethylperoxy)cyclohexane
  • Perhexa C 80
  • 1,1-Bis(t-butylperoxy)cyclohexane
  • Luperox 331XL
  • Luperox 331P80
  • PHC 40
  • Trigonox 22-70E
  • Perhexa C 79S

Work with 1,1-Bis(tert-butylperoxy)cyclohexane

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

Di-tert-butyl peroxide110-05-450 % similar 2,5-Dimethyl-2,5-di(tert-butylperoxy)hexane78-63-748 % similar 1,1-Diethoxycyclohexane1670-47-940 % similar 1,1-Bis(1-methylethoxy)cyclohexane1132-95-238 % similar 2,2-Bis(tert-butylperoxy)butane2167-23-938 % similar 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane6731-36-838 % similar Cyclohexanone peroxide12262-58-737 % similar 1-[(1-Hydroperoxycyclohexyl)dioxy]cyclohexanol78-18-237 % similar

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

Elsewhere

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