chempirical

1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane

C17H34O4CAS 6731-36-8302.46 g/mol

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Peroxide

Properties

Molecular formula
C17H34O4
Molar mass
302.46 g/mol
Exact mass
302.2457 Da
Melting point
90 °C (decomposes)
logP
5.02Crippen estimate
Polar surface area
36.9 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Identifiers

CAS number
6731-36-8
SMILES
CC1CC(C)(C)CC(OOC(C)(C)C)(OOC(C)(C)C)C1
InChIKey
NALFRYPTRXKZPN-UHFFFAOYSA-N
InChI
InChI=1S/C17H34O4/c1-13-10-16(8,9)12-17(11-13,20-18-14(2,3)4)21-19-15(5,6)7/h13H,10-12H2,1-9H3

Weigh it out

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

Names and synonyms

60 names · show all
  • Peroxide, 1,1′-(3,3,5-trimethylcyclohexylidene)bis[2-(1,1-dimethylethyl)
  • Peroxide, (3,3,5-trimethylcyclohexylidene)bis[tert-butyl
  • Peroxide, (3,3,5-trimethylcyclohexylidene)bis[(1,1-dimethylethyl)
  • 1,1′-(3,3,5-Trimethylcyclohexylidene)bis[2-(1,1-dimethylethyl) peroxide]
  • 1,1-Di-tert-butylperoxy-3,5,5-trimethylcyclohexane
  • 3,3,5-Trimethyl-1,1-bis(tert-butylperoxy)cyclohexane
  • 1,1-Bis(tert-butylperoxy)-3,5,5-trimethylcyclohexane
  • Trigonox 29B50
  • Lupersol 231
  • Trigonox 29/40
  • 1,1-Bis(tert-butyldioxy)-3,3,5-trimethylcyclohexane
  • Gem-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane
  • Luperco 231XL
  • 1,1-Di-tert-butylperoxy-3,3,5-trimethylcyclohexane
  • Trigonox 29B75
  • Gem-Di-tert-butylperoxy-3,3,5-trimethylcyclohexane
  • Perhexa 3M
  • Luperox 231
  • Luperco 231G
  • Trigonox 29
  • Luperco 231XLP
  • Varox 231XL
  • Trigonox 29/40MB
  • 1,1-Bis(tert-butyl)-3,3,5-trimethylcyclohexane peroxide
  • 1,1-Di(t-butylperoxy)-3,3,5-trimethylcyclohexane
  • Perhexa 3M40
  • Trigonox 29C75
  • Luperco 231G40
  • Tx 29
  • Trigonox 29B90
  • Lupersol 230XL
  • Luperox 231-50
  • Interox TMCH 40IC
  • Trigonox 29-40B-PD
  • Luperox 231XL
  • Lupersol L 231
  • Trigonox 29A
  • Sanperox CY 1.1
  • TX 29B50
  • Link-cup TMCH
  • Luperox 231XL40SP
  • USP 495D
  • Varox 231
  • Varox 231XL40
  • Luperox 231P75
  • Perhexa 3M40V
  • Trigonox 29-40B-GR
  • TX 29/40
  • 1,1-Bis(tert-butyloxy-oxy)3,3,5-trimethylcyclohexane
  • Irgacure 335
  • 1,2-tert-Butyl 3,3,5-trimethylcyclohexane peroxide
  • 1,1-Di(di-tert-butyl peroxy)-3,3,5-trimethylcyclohexane
  • TMCH
  • 1,1-Bis(t-butylperoxy)-3,3,5-trimethylcyclohexane
  • 3M
  • 1,1-Bis(1,1-dimethylethylperoxy)-3,3,5-trimethylcyclohexane
  • 1,1,5-Trimethyl-3,3-bis(tert-butylperoxy)cyclohexane
  • Trigonox 29E90
  • Peroxan PK 295V
  • Trigonox 29-40B-GR-E

Work with 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane

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

Isocetane4390-04-947 % similar 1,1-Bis(tert-butylperoxy)cyclohexane3006-86-838 % similar 3,3,5-Trimethylcyclohexane3073-66-335 % similar Di-tert-butyl peroxide110-05-435 % similar 3,3,5-Trimethylcyclohexanol116-02-933 % similar tert-Butyl peroxy-3,5,5-trimethylhexanoate13122-18-433 % similar 2,2,4,6,6-Pentamethylheptane13475-82-633 % similar 2,2,4,4,6-Pentamethylheptane62199-62-632 % similar

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

Same formula

1-Monomyristin589-68-4 1-Monomyristin75685-84-6

Elsewhere

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