Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester
TL;DR: Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester (CAS 2204-76-4) is a chemical compound with molecular formula C13H8Cl2N2O4 and molecular weight 325.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) N-(3,4-dichlorophenyl)carbamate
Also Known As: 4-Nitrophenyl (3,4-dichlorophenyl)carbamate, Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester, (4-nitrophenyl) N-(3,4-dichlorophenyl)carbamate
| Molecular Formula | C13H8Cl2N2O4 |
|---|---|
| Molecular Weight | 325.99 g/mol |
| LogP | 4.5125 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.9861 |
| Heavy Atoms | 21 |
| Complexity | 689.0707 |
Chemical Identifiers
| CAS Number | 2204-76-4 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester (CAS 2204-76-4), with molecular formula C13H8Cl2N2O4 and molecular weight 325.99 g/mol. IUPAC: (4-nitrophenyl) N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester
Property Insights of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester
The XLogP value of 4.5125 indicates that Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester 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 Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester. Following Lipinski's Rule of Five, Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester 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 Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester?
The CAS number of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester is 2204-76-4.
What is the molecular formula of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester?
The molecular formula of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester is C13H8Cl2N2O4.
What is the molecular weight of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester?
The molecular weight of Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester is 325.99 g/mol.
Where can I buy Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester?
You can request a quote for Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3,4-dichlorophenyl)-, 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.