N-(Nitrosomethyl)ethanolamine - CAS 26921-68-6
Catalog: |
BB058697 |
Product Name: |
N-(Nitrosomethyl)ethanolamine |
CAS: |
26921-68-6 |
Synonyms: |
2-(Methylnitrosoamino)ethanol; Methyl(2-hydroxyethyl)nitrosamine; Methyl(2-hydroxyethyl)nitrosoamine; N-Methyl-N-nitrosoethanolamine; N-Nitrosomethyl(2-hydroxyethyl)amine; NSC 124414 |
IUPAC Name: | N-(2-hydroxyethyl)-N-methylnitrous amide |
Description: | N-(Nitrosomethyl)ethanolamine can be used to study the chemical-molecular perspective of the liver specificity of the carcinogenicity of NOCs. |
Molecular Weight: | 104.11 |
Molecular Formula: | C3H8N2O2 |
Canonical SMILES: | CN(CCO)N=O |
InChI: | InChI=1S/C3H8N2O2/c1-5(4-7)2-3-6/h6H,2-3H2,1H3 |
InChI Key: | GFOKXZBYAVRDMO-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless to Pale Yellow Oil |
Storage: | 4°C, Inert atmosphere |
References: | Yuan, J., et.al. Chem. Res. Toxicol., 25, 2432-2442, (2012). |
GHS Hazard Statement: | H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity] |
Precautionary Statement: | P203, P280, P281, P318, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AT-523589-A2 | Personal security surveillance system and a method used in it | 20200311 |
CA-2789342-A1 | Solvent treatment process | 20100219 |
CN-102834162-A | Solvent treatment process | 20100219 |
EP-2536483-A1 | Solvent treatment process | 20100219 |
EP-2536483-B1 | Solvent treatment process | 20100219 |
KR-20130000394-A | Solvent Treatment Method | 20100219 |
US-2013053614-A1 | Solvent treatment process | 20100219 |
WO-2011100801-A1 | Solvent treatment process | 20100219 |
US-2010162416-A1 | Multi-stage stem cell carcinogenesis | 20080929 |
WO-2010037134-A2 | Multi-stage stem cell carcinogenesis | 20080929 |
Complexity: | 56.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 104.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 104.058577502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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