2,4-Dichloro-5-nitrophenyl ethyl carbonate
TL;DR: 2,4-Dichloro-5-nitrophenyl ethyl carbonate (CAS 62969-41-9) is a chemical compound with molecular formula C9H7Cl2NO5 and molecular weight 278.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichloro-5-nitrophenyl) ethyl carbonate
Also Known As: 2,4-dichloro-5-nitrophenyl ethyl carbonate, (2,4-dichloro-5-nitrophenyl) ethyl carbonate, 2,4-dichloro-5-nitrophenylethylcarbonate, (2,4-dichloro-5-nitro-phenyl) ethyl carbonate, Carbonic acid, 2,4-dichloro-5-nitrophenyl ethyl ester
| Molecular Formula | C9H7Cl2NO5 |
|---|---|
| Molecular Weight | 278.97 g/mol |
| LogP | 3.4369 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.97012 |
| Heavy Atoms | 17 |
| Complexity | 462.94458 |
Chemical Identifiers
| CAS Number | 62969-41-9 |
|---|---|
| SMILES | CCOC(=O)OC1=C(C=C(C(=C1)[N+](=O)[O-])Cl)Cl |
Product Overview
2,4-Dichloro-5-nitrophenyl ethyl carbonate (CAS 62969-41-9), with molecular formula C9H7Cl2NO5 and molecular weight 278.97 g/mol. IUPAC: (2,4-dichloro-5-nitrophenyl) ethyl carbonate.
Chemical Property Profile of 2,4-Dichloro-5-nitrophenyl ethyl carbonate
Property Insights of 2,4-Dichloro-5-nitrophenyl ethyl carbonate
The XLogP value of 3.4369 indicates that 2,4-Dichloro-5-nitrophenyl ethyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-5-nitrophenyl ethyl carbonate. Following Lipinski's Rule of Five, 2,4-Dichloro-5-nitrophenyl ethyl carbonate has 0 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 2,4-Dichloro-5-nitrophenyl ethyl carbonate?
The CAS number of 2,4-Dichloro-5-nitrophenyl ethyl carbonate is 62969-41-9.
What is the molecular formula of 2,4-Dichloro-5-nitrophenyl ethyl carbonate?
The molecular formula of 2,4-Dichloro-5-nitrophenyl ethyl carbonate is C9H7Cl2NO5.
What is the molecular weight of 2,4-Dichloro-5-nitrophenyl ethyl carbonate?
The molecular weight of 2,4-Dichloro-5-nitrophenyl ethyl carbonate is 278.97 g/mol.
Where can I buy 2,4-Dichloro-5-nitrophenyl ethyl carbonate?
You can request a quote for 2,4-Dichloro-5-nitrophenyl ethyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-5-nitrophenyl ethyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-5-nitrophenyl ethyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.