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25843-45-2 molecular structure
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methyl(methyl-oxo-$l^{5}-azanylidene)amine

ChemBase ID: 153173
Molecular Formular: C2H6N2O
Molecular Mass: 74.08184
Monoisotopic Mass: 74.04801282
SMILES and InChIs

SMILES:
C/N=[N+](/C)\[O-]
Canonical SMILES:
C/N=[N+](/C)\[O-]
InChI:
InChI=1S/C2H6N2O/c1-3-4(2)5/h1-2H3
InChIKey:
DGAKHGXRMXWHBX-UHFFFAOYSA-N

Cite this record

CBID:153173 http://www.chembase.cn/molecule-153173.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
methyl(methyl-oxo-$l^{5}-azanylidene)amine
IUPAC Traditional name
azoxymethane
Synonyms
AOM
Azoxymethane
CAS Number
25843-45-2
MDL Number
MFCD00126912
PubChem SID
24890698
162247312
PubChem CID
33184

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 33184 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.870623  LogD (pH = 7.4) -0.84027326 
Log P -0.83966386  Molar Refractivity 18.5372 cm3
Polarizability 6.93889 Å3 Polar Surface Area 41.11 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
97-99 °C(lit.) expand Show data source
Flash Point
24 °C expand Show data source
75.2 °F expand Show data source
Density
0.991 g/mL at 25 °C(lit.) expand Show data source
RTECS
PA2975000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
UN Number
1992 expand Show data source
2810 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
3 expand Show data source
6.1 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
45-46-10-25-36/38 expand Show data source
45-46-25 expand Show data source
Safety Statements
53-26-45 expand Show data source
53-45 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS06 expand Show data source
GHS08 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H226-H300-H315-H319-H350 expand Show data source
H300-H350 expand Show data source
GHS Precautionary statements
P201-P264-P301 + P310-P305 + P351 + P338-P308 + P313 expand Show data source
P201-P264-P301 + P310-P308 + P313 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 1992 3/PG 3 expand Show data source
UN 2810 6.1/PG 3 expand Show data source
Storage Temperature
-20°C expand Show data source
Purity
≥90% (GC) expand Show data source
≥98% expand Show data source
Concentration
13.4 M expand Show data source
Compostion
methylene chloride, ≤5% (solvent) expand Show data source
Contains
≤15% ethanol and acetic acid (Packaged based on azoxymethane.) expand Show data source
Quality
Practical grade expand Show data source
Linear Formula
CH3N=N(→O)CH3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - A2853 external link
Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Biochem/physiol Actions
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.
Sigma Aldrich - A5486 external link
Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Biochem/physiol Actions
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.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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