ethyl N-nitroso-N-(1-phenylethyl)carbamate
TL;DR: ethyl N-nitroso-N-(1-phenylethyl)carbamate (CAS 69975-69-5) is a chemical compound with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-nitroso-N-(1-phenylethyl)carbamate
Also Known As: ethyl N-nitroso-N-(1-phenylethyl)carbamate, ethyl nitroso(1-phenylethyl)carbamate
| Molecular Formula | C11H14N2O3 |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.10045 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 69975-69-5 |
|---|---|
| SMILES | CCOC(=O)N(C(C)C1=CC=CC=C1)N=O |
| InChIKey | YLYAMKIPLZTQQW-UHFFFAOYSA-N |
Product Overview
ethyl N-nitroso-N-(1-phenylethyl)carbamate (CAS 69975-69-5), with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol. IUPAC: ethyl N-nitroso-N-(1-phenylethyl)carbamate.
Chemical Property Profile of ethyl N-nitroso-N-(1-phenylethyl)carbamate
Property Insights of ethyl N-nitroso-N-(1-phenylethyl)carbamate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-nitroso-N-(1-phenylethyl)carbamate. With a topological polar surface area (TPSA) of 59.0 Ų, ethyl N-nitroso-N-(1-phenylethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-nitroso-N-(1-phenylethyl)carbamate 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-nitroso-N-(1-phenylethyl)carbamate?
The CAS number of ethyl N-nitroso-N-(1-phenylethyl)carbamate is 69975-69-5.
What is the molecular formula of ethyl N-nitroso-N-(1-phenylethyl)carbamate?
The molecular formula of ethyl N-nitroso-N-(1-phenylethyl)carbamate is C11H14N2O3.
What is the molecular weight of ethyl N-nitroso-N-(1-phenylethyl)carbamate?
The molecular weight of ethyl N-nitroso-N-(1-phenylethyl)carbamate is 222.10 g/mol.
Where can I buy ethyl N-nitroso-N-(1-phenylethyl)carbamate?
You can request a quote for ethyl N-nitroso-N-(1-phenylethyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-nitroso-N-(1-phenylethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-nitroso-N-(1-phenylethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.