Ethyl (4-amino-3-nitrophenyl)carbamate
TL;DR: Ethyl (4-amino-3-nitrophenyl)carbamate (CAS 25917-87-7) is a chemical compound with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(4-amino-3-nitrophenyl)carbamate
Also Known As: ethyl (4-amino-3-nitrophenyl)carbamate, ethyl N-(4-amino-3-nitrophenyl)carbamate, ethyl(4-amino-3-nitrophenyl)carbamate, ethyl N-(4-amino-3-nitro-phenyl)carbamate, N-(4-amino-3-nitrophenyl)ethoxycarboxamide
| Molecular Formula | C9H11N3O4 |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 1.7454 |
| Topological Polar Surface Area | 107.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.07495 |
| Heavy Atoms | 16 |
| Complexity | 419.21518 |
Chemical Identifiers
| CAS Number | 25917-87-7 |
|---|---|
| SMILES | CCOC(=O)NC1=CC(=C(C=C1)N)[N+](=O)[O-] |
Product Overview
Ethyl (4-amino-3-nitrophenyl)carbamate (CAS 25917-87-7), with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol. IUPAC: ethyl N-(4-amino-3-nitrophenyl)carbamate.
Chemical Property Profile of Ethyl (4-amino-3-nitrophenyl)carbamate
Property Insights of Ethyl (4-amino-3-nitrophenyl)carbamate
The XLogP value of 1.7454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (4-amino-3-nitrophenyl)carbamate. The TPSA of 107.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl (4-amino-3-nitrophenyl)carbamate. Following Lipinski's Rule of Five, Ethyl (4-amino-3-nitrophenyl)carbamate has 2 hydrogen bond donor(s) and 5 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 (4-amino-3-nitrophenyl)carbamate?
The CAS number of Ethyl (4-amino-3-nitrophenyl)carbamate is 25917-87-7.
What is the molecular formula of Ethyl (4-amino-3-nitrophenyl)carbamate?
The molecular formula of Ethyl (4-amino-3-nitrophenyl)carbamate is C9H11N3O4.
What is the molecular weight of Ethyl (4-amino-3-nitrophenyl)carbamate?
The molecular weight of Ethyl (4-amino-3-nitrophenyl)carbamate is 225.07 g/mol.
Where can I buy Ethyl (4-amino-3-nitrophenyl)carbamate?
You can request a quote for Ethyl (4-amino-3-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 (4-amino-3-nitrophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (4-amino-3-nitrophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.