N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine
TL;DR: N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine (CAS 112725-15-2) is a chemical compound with molecular formula C6H10N2O4 and molecular weight 174.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[methyl(nitroso)amino]-2-oxopropyl] acetate
Also Known As: N-MAOPN, N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine, [1-[methyl(nitroso)amino]-2-oxopropyl] acetate, N-Methyl-N-(acetoxy-2-oxopropyl)nitrosamine, 2-Propanone, 1-(acetyloxy)-1-(methylnitrosoamino)-
| Molecular Formula | C6H10N2O4 |
|---|---|
| Molecular Weight | 174.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.06406 |
| Heavy Atoms | 12 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 112725-15-2 |
|---|---|
| SMILES | CC(=O)C(N(C)N=O)OC(=O)C |
| InChIKey | HZSZBZLCMBKMOU-UHFFFAOYSA-N |
Product Overview
N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine (CAS 112725-15-2), with molecular formula C6H10N2O4 and molecular weight 174.06 g/mol. IUPAC: [1-[methyl(nitroso)amino]-2-oxopropyl] acetate.
Chemical Property Profile of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine
Property Insights of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine. Following Lipinski's Rule of Five, N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine?
The CAS number of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine is 112725-15-2.
What is the molecular formula of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine?
The molecular formula of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine is C6H10N2O4.
What is the molecular weight of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine?
The molecular weight of N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine is 174.06 g/mol.
Where can I buy N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine?
You can request a quote for N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-N-(1-acetoxy-2-oxopropyl)nitrosamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.