Ethyl N-ethyl-N-nitrosocarbamate
TL;DR: Ethyl N-ethyl-N-nitrosocarbamate (CAS 614-95-9) is a chemical compound with molecular formula C5H10N2O3 and molecular weight 146.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-ethyl-N-nitrosocarbamate
Also Known As: Nitrosoethylurethane, Ethylnitrosourethane, Nitrosoethylurethan, Ethyl nitrosourethan, Ethyl nitrosourethane
| Molecular Formula | C5H10N2O3 |
|---|---|
| Molecular Weight | 146.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.06914 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 614-95-9 |
|---|---|
| SMILES | CCN(C(=O)OCC)N=O |
| InChIKey | RAUQLNDTFONODT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl N-ethyl-N-nitrosocarbamate (CAS 614-95-9), with molecular formula C5H10N2O3 and molecular weight 146.07 g/mol. IUPAC: ethyl N-ethyl-N-nitrosocarbamate.
Chemical Property Profile of Ethyl N-ethyl-N-nitrosocarbamate
Property Insights of Ethyl N-ethyl-N-nitrosocarbamate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl N-ethyl-N-nitrosocarbamate. With a topological polar surface area (TPSA) of 59.0 Ų, Ethyl N-ethyl-N-nitrosocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl N-ethyl-N-nitrosocarbamate has 0 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 Ethyl N-ethyl-N-nitrosocarbamate?
The CAS number of Ethyl N-ethyl-N-nitrosocarbamate is 614-95-9.
What is the molecular formula of Ethyl N-ethyl-N-nitrosocarbamate?
The molecular formula of Ethyl N-ethyl-N-nitrosocarbamate is C5H10N2O3.
What is the molecular weight of Ethyl N-ethyl-N-nitrosocarbamate?
The molecular weight of Ethyl N-ethyl-N-nitrosocarbamate is 146.07 g/mol.
Where can I buy Ethyl N-ethyl-N-nitrosocarbamate?
You can request a quote for Ethyl N-ethyl-N-nitrosocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl N-ethyl-N-nitrosocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-ethyl-N-nitrosocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.