Chloramben-methyl
TL;DR: Chloramben-methyl (CAS 7286-84-2) is a chemical compound with molecular formula C8H7Cl2NO2 and molecular weight 218.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-amino-2,5-dichlorobenzoate
Also Known As: Chloramben-methyl, Methyl 3-amino-2,5-dichlorobenzoate, Chloramben methyl, Methyl chloramben, Amiben, methyl ester
| Molecular Formula | C8H7Cl2NO2 |
|---|---|
| Molecular Weight | 218.99 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.98538 |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 7286-84-2 |
|---|---|
| SMILES | COC(=O)C1=C(C(=CC(=C1)Cl)N)Cl |
| InChIKey | DTSSCQVCVYZGSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chloramben-methyl (CAS 7286-84-2), with molecular formula C8H7Cl2NO2 and molecular weight 218.99 g/mol. IUPAC: methyl 3-amino-2,5-dichlorobenzoate.
Chemical Property Profile of Chloramben-methyl
Property Insights of Chloramben-methyl
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloramben-methyl. With a topological polar surface area (TPSA) of 52.3 Ų, Chloramben-methyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chloramben-methyl has 1 hydrogen bond donor(s) and 3 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 Chloramben-methyl?
The CAS number of Chloramben-methyl is 7286-84-2.
What is the molecular formula of Chloramben-methyl?
The molecular formula of Chloramben-methyl is C8H7Cl2NO2.
What is the molecular weight of Chloramben-methyl?
The molecular weight of Chloramben-methyl is 218.99 g/mol.
Where can I buy Chloramben-methyl?
You can request a quote for Chloramben-methyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloramben-methyl?
Yes, KEHONG BIO provides custom synthesis services for Chloramben-methyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.