2,2′-Azobis(2-methylpropane) - ≥97% , CAS No.927-83-3

CAS: 927-83-3 Cat. No.: A469864 Molecular Weight: 142.24 EC Number: 627-515-9

GRADE & PURITY ≥97%

Synonyms

1,2-Bis(1,1-dimethylethyl)diazene | (E)-1,2-di-tert-butyldiazene | Diazene, 1,2-bis(1,1-dimethylethyl)- | trans-Di-tert-butyldiazene | Azoethane, 1,1,1',1'-tetramethyl- | 2,2'-Azobis(2-methylpropane) | Azo-tert-butane

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

1, 2-Bis(1, 1-dimethylethyl)diazene | (E)-1, 2-di-tert-butyldiazene | Diazene, 1, 2-bis(1, 1-dimethylethyl)- | trans-Di-tert-butyldiazene | Azoethane, 1, 1, 1', 1'-tetramethyl- | 2, 2'-Azobis(2-methylpropane) | Azo-tert-butane

Specifications & Purity

≥97%

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)N=NC(C)(C)C
• IUPAC Name: ditert-butyldiazene
• InChIKey: GKCPCPKXFGQXGS-UHFFFAOYSA-N
• INCHI: 1S/C8H18N2/c1-7(2,3)9-10-8(4,5)6/h1-6H3
• Isomeric SMILES: CC(C)(C)N=NC(C)(C)C
• WGK Germany: 3
• UN Number: 1993
• Packing Group: II
• Molecular Weight: 142.24
• Reaxy-Rn: 1749274
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1749274&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Azo compounds

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Azo compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Azo compounds
• Alternative Parents: Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Azo compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as azo compounds. These are derivatives of diazene(diimide), HN=NH, wherein both hydrogens are substituted by hydrocarbyl groups, e.g. PhN=NPh azobenzene or diphenyldiazene.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Refractive Index: n20/D 1.397 (lit.)
• Flash Point(°F): 44.6 °F
• Flash Point(°C): 7 °C
• Boil Point(°C): 47-48 °C/8 mmHg (lit.)
• Molecular Weight: 142.240 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 142.147 Da
• Monoisotopic Mass: 142.147 Da
• Topological Polar Surface Area: 24.700 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 107.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1