Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)- supplier

Name
AZO-TERT-OCTANE
EINECS
CAS No. 39198-34-0
Article Data5
CAS DataBase
Density 0.815 g/cm³
Solubility
Melting Point
Formula C₁₆H₃₄N₂
Boiling Point 292.793 °C at 760 mmHg
Molecular Weight 254.459
Flash Point 122.776 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Diazene,bis(1,1,3,3-tetramethylbutyl)- (9CI);1,1,1',1',3,3,3',3'-Octamethyl-1,1'-azobutane;2,2'-Azobis(2,4,4-trimethylpentane);Azo-tert-octane;Di-tert-octyldiazene;VR 110;Bis(2,4,4-trimethylpentan-2-yl)diazene;
PSA 24.72000
LogP 5.86820

Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)- Specification

The Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)-, with the CAS registry number 39198-34-0, is also known as 2,2'-Azobis(2,4,4-trimethylpentane). This chemical's molecular formula is C₁₆H₃₄N₂ and molecular weight is 254.45. What's more, its systematic name is bis(2,4,4-trimethylpentan-2-yl)diazene.

Physical properties of Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)- are: (1)ACD/LogP: 6.76; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.762; (4)ACD/LogD (pH 7.4): 6.762; (5)ACD/BCF (pH 5.5): 81087.273; (6)ACD/BCF (pH 7.4): 81087.273; (7)ACD/KOC (pH 5.5): 113607.758; (8)ACD/KOC (pH 7.4): 113607.758; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 24.72 Å²; (13)Index of Refraction: 1.442; (14)Molar Refractivity: 82.672 cm³; (15)Molar Volume: 312.4 cm³; (16)Polarizability: 32.774×10^-24cm³; (17)Surface Tension: 24.635 dyne/cm; (18)Density: 0.815 g/cm³; (19)Flash Point: 122.776 °C; (20)Enthalpy of Vaporization: 51.1 kJ/mol; (21)Boiling Point: 292.793 °C at 760 mmHg; (22)Vapour Pressure: 0.003 mmHg at 25°C.

Preparation of Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)-: this chemical can be prepared by Bis(1.1.3.3.-Tetramethylbutyl)-thiadiaziridin-1.1-dioxid at the temperature of 80 °C. This reaction will need reagent NaOH and solvent H₂O with the reaction time of 30 min. The yield is about 90%.

Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)- can be prepared by Bis(1.1.3.3.-Tetramethylbutyl)-thiadiaziridin-1.1-dioxid at the temperature of 80 °C

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)CC(C)(C)N=NC(C)(C)CC(C)(C)C
(2)InChI: InChI=1S/C16H34N2/c1-13(2,3)11-15(7,8)17-18-16(9,10)12-14(4,5)6/h11-12H2,1-10H3
(3)InChIKey: WPKWPKDNOPEODE-UHFFFAOYSA-N

Product Name

AZO-TERT-OCTANE

Diazene,1,2-bis(1,1,3,3-tetramethylbutyl)- Specification

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