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CAS No.: | 3851-87-4 |
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Name: | 3,5,5-Trimethylhexanoyl peroxide |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C18H34O4 |
Molecular Weight: | 314.466 |
Synonyms: | Bis(3,5,5-trimethylhexanoyl) peroxide;Lup 219;Luperox 219;Peroyl 355;Trigonox 36;Trigonox 36C75;USP 355M; |
EINECS: | 223-356-0 |
Density: | 0.943 g/cm3 |
Melting Point: | 79oC |
Boiling Point: | 359.5 °C at 760 mmHg |
Flash Point: | 149.8 °C |
Solubility: | Soluble |
Appearance: | white crystals or powder |
Hazard Symbols: | O,Xi,Xn,T |
Risk Codes: | R8; R36/37/38; R22; R61; R20/21/22 |
PSA: | 52.60000 |
LogP: | 4.91260 |
Conditions | Yield |
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With dihydrogen peroxide In pentane at 70 - 80℃; for 8h; Solvent; Temperature; | 94% |
With dmap; dihydrogen peroxide; dicyclohexyl-carbodiimide In dichloromethane at -5 - 0℃; for 2h; Inert atmosphere; | 72% |
Stage #1: 3,5,5-trimethylhexanoic acid With dmap; dihydrogen peroxide In dichloromethane at -15℃; for 0.166667h; Inert atmosphere; Stage #2: With dicyclohexyl-carbodiimide In dichloromethane at -15 - 10℃; for 1.5h; Inert atmosphere; |
isononanoyl chloride
bis(3,5,5-trimethylhexanoyl) peroxide
Conditions | Yield |
---|---|
With dihydrogen peroxide In water at 26 - 32℃; | 92% |
With dihydrogen peroxide; potassium hydroxide In water at 5 - 40℃; for 0.0166667h; Temperature; Flow reactor; | 92.3% |
Conditions | Yield |
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With iron(III) trifluoromethanesulfonate In acetonitrile at 80℃; for 5h; Inert atmosphere; Schlenk technique; Green chemistry; | 83% |
Conditions | Yield |
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With trifluorormethanesulfonic acid In acetonitrile at 80℃; for 12h; Inert atmosphere; Schlenk technique; | 73% |
Conditions | Yield |
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With tetrakis(actonitrile)copper(I) hexafluorophosphate; 2,6-bis[4′-isopropyloxazolin-2′-yl]pyridine; N-ethyl-N,N-diisopropylamine In tetrahydrofuran at 20℃; for 12h; Schlenk technique; Inert atmosphere; | 69% |
Conditions | Yield |
---|---|
Stage #1: phenylacetylene; bis(3,5,5-trimethylhexanoyl) peroxide With iron(III) trifluoromethanesulfonate In tetrahydrofuran at 60℃; for 1h; Schlenk technique; Inert atmosphere; Sealed tube; Stage #2: With trifluorormethanesulfonic acid In tetrahydrofuran at 100℃; for 12h; Schlenk technique; Inert atmosphere; Sealed tube; | 68% |
Conditions | Yield |
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With tris(bipyridine)ruthenium(II) dichloride hexahydrate; copper diacetate; triethylamine tris(hydrogen fluoride) In 1,2-dichloro-ethane at 20℃; for 24h; Schlenk technique; Inert atmosphere; Irradiation; | 60% |
bis(3,5,5-trimethylhexanoyl) peroxide
A
2,2,4-trimethylpentane
B
2,4,4-trimethylpentan-1-ol
C
2,2,4,7,9,9-hexamethyldecane
D
3,5,5-trimethylhexanoic acid
E
bis(3,5,5-trimethylhexanoic) anhydride
Conditions | Yield |
---|---|
With pentadecane at 80℃; under 750060 Torr; Product distribution; Rate constant; Thermodynamic data; var. of temp., pressure, solvent, EA, ΔV(excit.); | A 0.625 mol B 0.009 mol C 0.394 mol D 0.038 mol E 0.005 mol F 0.126 mol |
Conditions | Yield |
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With 2-methylundecane In acetonitrile at 70℃; under 1500120 Torr; for 16h; Rate constant; Thermodynamic data; Kinetics; var. of solvent, temp., pressure, without additive, EA, ΔV(excit.); |
bis(3,5,5-trimethylhexanoyl) peroxide
Conditions | Yield |
---|---|
With 5,5-Dimethyl-1-pyrroline N-oxide In benzene at 39.85℃; Product distribution; Further Variations:; Temperatures; Reagents; Decomposition; |
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IUPAC Name: 3,5,5-Trimethylhexanoyl 3,5,5-trimethylhexaneperoxoate
Empirical Formula: C18H34O4
Molecular Weight: 314.4602
Einecs: 223-356-0
Freely Rotating Bonds: 11
Polar Surface Area: 52.6Å2
Index of Refraction: 1.445
Molar Refractivity: 88.83 cm3
Molar Volume: 333.4 cm3
Polarizability: 35.21 ×10-24 cm3
Surface Tension: 30.3 dyne/cm
Density: 0.942 g/cm3
Flash Point: 149.8 °C
Enthalpy of Vaporization: 60.51 kJ/mol
Boiling Point: 359.5 °C at 760 mmHg
Vapour Pressure: 2.37E-05 mmHg at 25°C
The Cas Register Number of Peroxide,bis(3,5,5-trimethyl-1-oxohexyl) is 3851-87-4.The chemical synonyms of Peroxide,bis(3,5,5-trimethyl-1-oxohexyl) (CAS NO.3851-87-4) are Bis(3,5,5-trimethylhexanoyl) peroxide .The molecular structure of Peroxide,bis(3,5,5-trimethyl-1-oxohexyl) (CAS NO.3851-87-4) is
.
Peroxide,bis(3,5,5-trimethyl-1-oxohexyl) (CAS NO.3851-87-4) is used in organic synthesis.
RIDADR: 3106
HazardClass: 5.2
PackingGroup: II