2-(Ethylnitrosoamino)ethanol acetate
TL;DR: 2-(Ethylnitrosoamino)ethanol acetate (CAS 65986-78-9) is a chemical compound with molecular formula C6H12N2O3 and molecular weight 160.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethyl(nitroso)amino]ethyl acetate
Also Known As: 2-(Ethylnitrosoamino)ethanol acetate, 2-[ethyl(nitroso)amino]ethyl acetate, Acetic acid 2-(ethylnitrosoamino)ethyl, N-Ethyl-N-(2-acetoxyethyl)nitrosamine, N-Ethyl-N-(2-acetoxyethyl)nitrosoamine
| Molecular Formula | C6H12N2O3 |
|---|---|
| Molecular Weight | 160.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 160.0848 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 65986-78-9 |
|---|---|
| SMILES | CCN(CCOC(=O)C)N=O |
| InChIKey | AHCPBURQVNYRRC-UHFFFAOYSA-N |
Product Overview
2-(Ethylnitrosoamino)ethanol acetate (CAS 65986-78-9), with molecular formula C6H12N2O3 and molecular weight 160.08 g/mol. IUPAC: 2-[ethyl(nitroso)amino]ethyl acetate.
Chemical Property Profile of 2-(Ethylnitrosoamino)ethanol acetate
Property Insights of 2-(Ethylnitrosoamino)ethanol acetate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethylnitrosoamino)ethanol acetate. With a topological polar surface area (TPSA) of 59.0 Ų, 2-(Ethylnitrosoamino)ethanol acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Ethylnitrosoamino)ethanol acetate has 0 hydrogen bond donor(s) and 5 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 2-(Ethylnitrosoamino)ethanol acetate?
The CAS number of 2-(Ethylnitrosoamino)ethanol acetate is 65986-78-9.
What is the molecular formula of 2-(Ethylnitrosoamino)ethanol acetate?
The molecular formula of 2-(Ethylnitrosoamino)ethanol acetate is C6H12N2O3.
What is the molecular weight of 2-(Ethylnitrosoamino)ethanol acetate?
The molecular weight of 2-(Ethylnitrosoamino)ethanol acetate is 160.08 g/mol.
Where can I buy 2-(Ethylnitrosoamino)ethanol acetate?
You can request a quote for 2-(Ethylnitrosoamino)ethanol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Ethylnitrosoamino)ethanol acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethylnitrosoamino)ethanol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.