Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester
TL;DR: Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester (CAS 88599-65-9) is a chemical compound with molecular formula C14H8Cl3NO4 and molecular weight 358.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichlorophenyl) 2-carbamoyloxy-5-chlorobenzoate
Also Known As: 2,4-Dichlorophenyl 2-((aminocarbonyl)oxy)-5-chlorobenzoate, Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester, (2,4-dichlorophenyl) 2-carbamoyloxy-5-chlorobenzoate, 2,4-Dichlorophenyl 2-(carbamoyloxy)-5-chlorobenzoate, RefChem:326716
| Molecular Formula | C14H8Cl3NO4 |
|---|---|
| Molecular Weight | 358.95 g/mol |
| LogP | 4.3235 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.9519 |
| Heavy Atoms | 22 |
| Complexity | 748.863 |
Chemical Identifiers
| CAS Number | 88599-65-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)C(=O)OC2=C(C=C(C=C2)Cl)Cl)OC(=O)N |
Product Overview
Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester (CAS 88599-65-9), with molecular formula C14H8Cl3NO4 and molecular weight 358.95 g/mol. IUPAC: (2,4-dichlorophenyl) 2-carbamoyloxy-5-chlorobenzoate.
Chemical Property Profile of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester
Property Insights of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester
The XLogP value of 4.3235 indicates that Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl 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 Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester?
The CAS number of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester is 88599-65-9.
What is the molecular formula of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester?
The molecular formula of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester is C14H8Cl3NO4.
What is the molecular weight of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester?
The molecular weight of Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester is 358.95 g/mol.
Where can I buy Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester?
You can request a quote for Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((aminocarbonyl)oxy)-5-chloro-, 2,4-dichlorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.