Azoxymethane - ≥95% , CAS No.25843-45-2

CAS: 25843-45-2 Cat. No.: A169090 Formula: C₂H₆N₂O Molecular Weight: 74.08 EC Number: 620-649-9

GRADE & PURITY ≥95%

Synonyms

(E)-dimethyldiazen-1-ium-1-olate|(Methyl-ONN-azoxy)methane|AOM|(E)-1,2-dimethyldiazene oxide|methyl-methylimino-oxidoazanium|[(Z)-methyl-NNO-azoxy]methane|AZOXYMETHANE|Diazene, dimethyl-, 1-oxide|Methane, azoxy-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

(E)-dimethyldiazen-1-ium-1-olate | (Methyl-ONN-azoxy)methane | AOM | (E)-1,2-dimethyldiazene oxide | methyl-methylimino-oxidoazanium | [(Z)-methyl-NNO-azoxy]methane | AZOXYMETHANE | Diazene, dimethyl-, 1-oxide | Methane, azoxy-

Specifications & Purity

≥95%

Biochemical and Physiological Mechanisms

Carcinogen that induces O6-methylguanine adducts in DNA leading to G→A transitions. Induces tumorigenesis in the colon of laboratory animals and is used to study the mechanism of cancer progression and chemoprevention.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Purity

≥95%

Names and Identifiers

Pubchem Sid

528772483

Canonical Smiles

CN=[N+](C)[O-]

IUPAC Name

methyl-methylimino-oxidoazanium

InChIKey

DGAKHGXRMXWHBX-UHFFFAOYSA-N

INCHI

1S/C2H6N2O/c1-3-4(2)5/h1-2H3

Isomeric SMILES

CN=[N+](C)[O-]

UN Number

2810

Packing Group

I

Molecular Weight

74.08

Reaxy-Rn

8137360

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8137360&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic 1,3-dipolar compounds
    • Class Allyl-type 1,3-dipolar organic compounds
      • Subclass Azoxy compounds

• Kingdom: Organic compounds
• Superclass: Organic 1,3-dipolar compounds
• Class: Allyl-type 1,3-dipolar organic compounds
• Subclass: Azoxy compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Azoxy compounds
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Azoxy compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as azoxy compounds. These are organic compounds sharing a common functional group with the general structure RN=N+(O-)R.
• 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

• x_flash_point_drop_centigrade: 24℃
• x_boil_point_char: 97-99 °C
• Molecular Weight: 74.080 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 74.048 Da
• Monoisotopic Mass: 74.048 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 49.600
• 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