Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate
TL;DR: Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate (CAS 76532-49-5) is a chemical compound with molecular formula C14H11Cl2NO4 and molecular weight 327.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate
Also Known As: Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate, Benzoic acid, 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)-, methyl ester
| Molecular Formula | C14H11Cl2NO4 |
|---|---|
| Molecular Weight | 327.01 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.0065 |
| Heavy Atoms | 21 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 76532-49-5 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)NO |
| InChIKey | KELURORTRCKTHF-UHFFFAOYSA-N |
Product Overview
Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate (CAS 76532-49-5), with molecular formula C14H11Cl2NO4 and molecular weight 327.01 g/mol. IUPAC: methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate.
Chemical Property Profile of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate
Property Insights of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate
The XLogP value of 4.7 indicates that Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate. Following Lipinski's Rule of Five, Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate has 2 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 Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate?
The CAS number of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate is 76532-49-5.
What is the molecular formula of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate?
The molecular formula of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate is C14H11Cl2NO4.
What is the molecular weight of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate?
The molecular weight of Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate is 327.01 g/mol.
Where can I buy Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate?
You can request a quote for Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(2,4-dichlorophenoxy)-2-(hydroxyamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.