Chloramben-ammonium
TL;DR: Chloramben-ammonium (CAS 1076-46-6) is a chemical compound with molecular formula C7H8Cl2N2O2 and molecular weight 222.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 3-amino-2,5-dichlorobenzoate
Also Known As: Chloramben-ammonium, Ammonium chloramben, Chloramben ammonium salt, chloramben ammonium, Caswell No. 168B
| Molecular Formula | C7H8Cl2N2O2 |
|---|---|
| Molecular Weight | 222.00 g/mol |
| LogP | 1.32 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 221.99628 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 1076-46-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)[O-])Cl)N)Cl.[NH4+] |
| InChIKey | RSSKZIYCSDAOJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chloramben-ammonium (CAS 1076-46-6), with molecular formula C7H8Cl2N2O2 and molecular weight 222.00 g/mol. IUPAC: azanium 3-amino-2,5-dichlorobenzoate.
Chemical Property Profile of Chloramben-ammonium
Property Insights of Chloramben-ammonium
The XLogP value of 1.32 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloramben-ammonium. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloramben-ammonium. Following Lipinski's Rule of Five, Chloramben-ammonium has 2 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-ammonium?
The CAS number of Chloramben-ammonium is 1076-46-6.
What is the molecular formula of Chloramben-ammonium?
The molecular formula of Chloramben-ammonium is C7H8Cl2N2O2.
What is the molecular weight of Chloramben-ammonium?
The molecular weight of Chloramben-ammonium is 222.00 g/mol.
Where can I buy Chloramben-ammonium?
You can request a quote for Chloramben-ammonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloramben-ammonium?
Yes, KEHONG BIO provides custom synthesis services for Chloramben-ammonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.