Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate
TL;DR: Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate (CAS 199189-73-6) is a chemical compound with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(4,5-dimethyl-2-nitrophenyl)carbamate
Also Known As: Ethyl(4,5-dimethyl-2-nitrophenyl)carbamate, Ethyl (4,5-dimethyl-2-nitrophenyl)carbamate, ethyl N-(4,5-dimethyl-2-nitrophenyl)carbamate, Ethyl N-(4,5-dimethyl-2-nitro-phenyl)carbamate, (4,5-dimethyl-2-nitro-phenyl)-carbamic acid ethyl ester
| Molecular Formula | C11H14N2O4 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 2.78004 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.09535 |
| Heavy Atoms | 17 |
| Complexity | 457.02982 |
Chemical Identifiers
| CAS Number | 199189-73-6 |
|---|---|
| SMILES | CCOC(=O)NC1=C(C=C(C(=C1)C)C)[N+](=O)[O-] |
Product Overview
Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate (CAS 199189-73-6), with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol. IUPAC: ethyl N-(4,5-dimethyl-2-nitrophenyl)carbamate.
Chemical Property Profile of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate
Property Insights of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate
The XLogP value of 2.78004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate. Following Lipinski's Rule of Five, Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate 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 Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate?
The CAS number of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate is 199189-73-6.
What is the molecular formula of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate?
The molecular formula of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate is C11H14N2O4.
What is the molecular weight of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate?
The molecular weight of Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate is 238.10 g/mol.
Where can I buy Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate?
You can request a quote for Ethyl N-(4,5-dimethyl-2-nitrophenyl)-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-(4,5-dimethyl-2-nitrophenyl)-carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-(4,5-dimethyl-2-nitrophenyl)-carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.