2-(Ethylnitrosoamino)ethanol
TL;DR: 2-(Ethylnitrosoamino)ethanol (CAS 13147-25-6) is a chemical compound with molecular formula C4H10N2O2 and molecular weight 118.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-(2-hydroxyethyl)nitrous amide
Also Known As: N-Ethyl-N-(2-hydroxyethyl)nitrosamine, Ethylethanolnitrosamine, EENA, EHEN, AlphaArbutin
| Molecular Formula | C4H10N2O2 |
|---|---|
| Molecular Weight | 118.07 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.07423 |
| Heavy Atoms | 8 |
| Complexity | 67.0 |
| Vapor Pressure | 0.000906 [mmHg] |
Chemical Identifiers
| CAS Number | 13147-25-6 |
|---|---|
| SMILES | CCN(CCO)N=O |
| InChIKey | HNQBPUIXFDQDRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Ethylnitrosoamino)ethanol (CAS 13147-25-6), with molecular formula C4H10N2O2 and molecular weight 118.07 g/mol. IUPAC: N-ethyl-N-(2-hydroxyethyl)nitrous amide.
Chemical Property Profile of 2-(Ethylnitrosoamino)ethanol
Property Insights of 2-(Ethylnitrosoamino)ethanol
The XLogP value of -0.1 indicates that 2-(Ethylnitrosoamino)ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.9 Ų, 2-(Ethylnitrosoamino)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Ethylnitrosoamino)ethanol has 1 hydrogen bond donor(s) and 4 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?
The CAS number of 2-(Ethylnitrosoamino)ethanol is 13147-25-6.
What is the molecular formula of 2-(Ethylnitrosoamino)ethanol?
The molecular formula of 2-(Ethylnitrosoamino)ethanol is C4H10N2O2.
What is the molecular weight of 2-(Ethylnitrosoamino)ethanol?
The molecular weight of 2-(Ethylnitrosoamino)ethanol is 118.07 g/mol.
Where can I buy 2-(Ethylnitrosoamino)ethanol?
You can request a quote for 2-(Ethylnitrosoamino)ethanol 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?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethylnitrosoamino)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.