N-亚硝基二乙醇胺二醋酸酯
TL;DR: N-亚硝基二乙醇胺二醋酸酯 (CAS 13256-19-4) is a chemical compound with molecular formula C8H14N2O5 and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-亚硝基二乙醇胺二醋酸酯
2-[2-acetyloxyethyl(nitroso)amino]ethyl acetate
Also Known As: N-Nitrosodiethanolamine diacetate, N-Nitrosobis(acetoxyethyl)amine, Bis-(acetoxyaethyl)nitrosamin, N-Nitroso-2,2'-iminodiethanol diacetate, Bis-(acetoxyaethyl)nitrosamin [German]
| Molecular Formula | C8H14N2O5 |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.09027 |
| Heavy Atoms | 15 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 13256-19-4 |
|---|---|
| SMILES | CC(=O)OCCN(CCOC(=O)C)N=O |
| InChIKey | KBGJEXGMSFHMPC-UHFFFAOYSA-N |
Product Overview
N-亚硝基二乙醇胺二醋酸酯 (CAS 13256-19-4), with molecular formula C8H14N2O5 and molecular weight 218.09 g/mol. IUPAC: 2-[2-acetyloxyethyl(nitroso)amino]ethyl acetate.
Chemical Property Profile of N-亚硝基二乙醇胺二醋酸酯
Property Insights of N-亚硝基二乙醇胺二醋酸酯
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-亚硝基二乙醇胺二醋酸酯. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-亚硝基二乙醇胺二醋酸酯. Following Lipinski's Rule of Five, N-亚硝基二乙醇胺二醋酸酯 has 0 hydrogen bond donor(s) and 7 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-亚硝基二乙醇胺二醋酸酯?
The CAS number of N-亚硝基二乙醇胺二醋酸酯 is 13256-19-4.
What is the molecular formula of N-亚硝基二乙醇胺二醋酸酯?
The molecular formula of N-亚硝基二乙醇胺二醋酸酯 is C8H14N2O5.
What is the molecular weight of N-亚硝基二乙醇胺二醋酸酯?
The molecular weight of N-亚硝基二乙醇胺二醋酸酯 is 218.09 g/mol.
Where can I buy N-亚硝基二乙醇胺二醋酸酯?
You can request a quote for N-亚硝基二乙醇胺二醋酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-亚硝基二乙醇胺二醋酸酯?
Yes, KEHONG BIO provides custom synthesis services for N-亚硝基二乙醇胺二醋酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.