N-乙基-N-亚硝基脲
TL;DR: N-乙基-N-亚硝基脲 (CAS 759-73-9) is a chemical compound with molecular formula C3H7N3O2 and molecular weight 117.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙基-N-亚硝基脲
1-ethyl-1-nitrosourea
Also Known As: 1-Ethyl-1-nitrosourea, N-Ethyl-N-nitrosourea, Ethylnitrosourea, N-NITROSO-N-ETHYLUREA, Ethyl nitrosourea
| Molecular Formula | C3H7N3O2 |
|---|---|
| Molecular Weight | 117.05 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 75.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 117.053825 |
| Heavy Atoms | 8 |
| Complexity | 103.0 |
| Melting Point | 217 to 103.9 °C (decomposes) |
| Solubility | 10 to 50 mg/mL at 70 °F (NTP, 1992) |
| Vapor Pressure | 0.01 [mmHg] |
Chemical Identifiers
| CAS Number | 759-73-9 |
|---|---|
| SMILES | CCN(C(=O)N)N=O |
| InChIKey | FUSGACRLAFQQRL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙基-N-亚硝基脲 (CAS 759-73-9), with molecular formula C3H7N3O2 and molecular weight 117.05 g/mol. IUPAC: 1-ethyl-1-nitrosourea.
Chemical Property Profile of N-乙基-N-亚硝基脲
Property Insights of N-乙基-N-亚硝基脲
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙基-N-亚硝基脲. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-乙基-N-亚硝基脲. Following Lipinski's Rule of Five, N-乙基-N-亚硝基脲 has 1 hydrogen bond donor(s) and 3 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-乙基-N-亚硝基脲?
The CAS number of N-乙基-N-亚硝基脲 is 759-73-9.
What is the molecular formula of N-乙基-N-亚硝基脲?
The molecular formula of N-乙基-N-亚硝基脲 is C3H7N3O2.
What is the molecular weight of N-乙基-N-亚硝基脲?
The molecular weight of N-乙基-N-亚硝基脲 is 117.05 g/mol.
Where can I buy N-乙基-N-亚硝基脲?
You can request a quote for N-乙基-N-亚硝基脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙基-N-亚硝基脲?
Yes, KEHONG BIO provides custom synthesis services for N-乙基-N-亚硝基脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.