2-Nitrophenyl 2,4-dichlorobenzoate
TL;DR: 2-Nitrophenyl 2,4-dichlorobenzoate (CAS 7510-12-5) is a chemical compound with molecular formula C13H7Cl2NO4 and molecular weight 310.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrophenyl) 2,4-dichlorobenzoate
Also Known As: 2-nitrophenyl 2,4-dichlorobenzoate, (2-nitrophenyl) 2,4-dichlorobenzoate, AN-329/05511043
| Molecular Formula | C13H7Cl2NO4 |
|---|---|
| Molecular Weight | 310.98 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.97522 |
| Heavy Atoms | 20 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 7510-12-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OC(=O)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | MBXOPIVTHZMABE-UHFFFAOYSA-N |
Product Overview
2-Nitrophenyl 2,4-dichlorobenzoate (CAS 7510-12-5), with molecular formula C13H7Cl2NO4 and molecular weight 310.98 g/mol. IUPAC: (2-nitrophenyl) 2,4-dichlorobenzoate.
Chemical Property Profile of 2-Nitrophenyl 2,4-dichlorobenzoate
Property Insights of 2-Nitrophenyl 2,4-dichlorobenzoate
The XLogP value of 4.7 indicates that 2-Nitrophenyl 2,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrophenyl 2,4-dichlorobenzoate. Following Lipinski's Rule of Five, 2-Nitrophenyl 2,4-dichlorobenzoate has 0 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 2,4-dichlorobenzoate?
The CAS number of 2-Nitrophenyl 2,4-dichlorobenzoate is 7510-12-5.
What is the molecular formula of 2-Nitrophenyl 2,4-dichlorobenzoate?
The molecular formula of 2-Nitrophenyl 2,4-dichlorobenzoate is C13H7Cl2NO4.
What is the molecular weight of 2-Nitrophenyl 2,4-dichlorobenzoate?
The molecular weight of 2-Nitrophenyl 2,4-dichlorobenzoate is 310.98 g/mol.
Where can I buy 2-Nitrophenyl 2,4-dichlorobenzoate?
You can request a quote for 2-Nitrophenyl 2,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrophenyl 2,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrophenyl 2,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.