2-Nitrophenyl (4-chlorophenyl)carbamate
TL;DR: 2-Nitrophenyl (4-chlorophenyl)carbamate (CAS 304453-27-8) is a chemical compound with molecular formula C13H9ClN2O4 and molecular weight 292.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrophenyl) N-(4-chlorophenyl)carbamate
Also Known As: 2-nitrophenyl (4-chlorophenyl)carbamate, BIM-0013462.P001, (2-nitrophenyl) N-(4-chlorophenyl)carbamate
| Molecular Formula | C13H9ClN2O4 |
|---|---|
| Molecular Weight | 292.03 g/mol |
| LogP | 3.8591 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0251 |
| Heavy Atoms | 20 |
| Complexity | 643.07434 |
Chemical Identifiers
| CAS Number | 304453-27-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OC(=O)NC2=CC=C(C=C2)Cl |
Product Overview
2-Nitrophenyl (4-chlorophenyl)carbamate (CAS 304453-27-8), with molecular formula C13H9ClN2O4 and molecular weight 292.03 g/mol. IUPAC: (2-nitrophenyl) N-(4-chlorophenyl)carbamate.
Chemical Property Profile of 2-Nitrophenyl (4-chlorophenyl)carbamate
Property Insights of 2-Nitrophenyl (4-chlorophenyl)carbamate
The XLogP value of 3.8591 indicates that 2-Nitrophenyl (4-chlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrophenyl (4-chlorophenyl)carbamate. Following Lipinski's Rule of Five, 2-Nitrophenyl (4-chlorophenyl)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 2-Nitrophenyl (4-chlorophenyl)carbamate?
The CAS number of 2-Nitrophenyl (4-chlorophenyl)carbamate is 304453-27-8.
What is the molecular formula of 2-Nitrophenyl (4-chlorophenyl)carbamate?
The molecular formula of 2-Nitrophenyl (4-chlorophenyl)carbamate is C13H9ClN2O4.
What is the molecular weight of 2-Nitrophenyl (4-chlorophenyl)carbamate?
The molecular weight of 2-Nitrophenyl (4-chlorophenyl)carbamate is 292.03 g/mol.
Where can I buy 2-Nitrophenyl (4-chlorophenyl)carbamate?
You can request a quote for 2-Nitrophenyl (4-chlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrophenyl (4-chlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrophenyl (4-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.