1,2,4-Benzenetriamine, hydrochloride (1:2)
TL;DR: 1,2,4-Benzenetriamine, hydrochloride (1:2) (CAS 615-47-4) is a chemical compound with molecular formula C6H11Cl2N3 and molecular weight 195.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,2,4-triamine;dihydrochloride
Also Known As: 1,2,4-Benzenetriamine dihydrochloride, 1,2,4-Triaminobenzene dihydrochloride, benzene-1,2,4-triamine dihydrochloride, 1,2,4-Benzenetriamine, dihydrochloride, 1,2,4-Triaminobenzene 2HCl
| Molecular Formula | C6H11Cl2N3 |
|---|---|
| Molecular Weight | 195.03 g/mol |
| LogP | 1.28 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.033 |
| Heavy Atoms | 11 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 615-47-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)N)N.Cl.Cl |
| InChIKey | RKMFFOLUBJFMBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,4-Benzenetriamine, hydrochloride (1:2) (CAS 615-47-4), with molecular formula C6H11Cl2N3 and molecular weight 195.03 g/mol. IUPAC: benzene-1,2,4-triamine;dihydrochloride.
Chemical Property Profile of 1,2,4-Benzenetriamine, hydrochloride (1:2)
Property Insights of 1,2,4-Benzenetriamine, hydrochloride (1:2)
The XLogP value of 1.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Benzenetriamine, hydrochloride (1:2). The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Benzenetriamine, hydrochloride (1:2). Following Lipinski's Rule of Five, 1,2,4-Benzenetriamine, hydrochloride (1:2) has 5 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 1,2,4-Benzenetriamine, hydrochloride (1:2)?
The CAS number of 1,2,4-Benzenetriamine, hydrochloride (1:2) is 615-47-4.
What is the molecular formula of 1,2,4-Benzenetriamine, hydrochloride (1:2)?
The molecular formula of 1,2,4-Benzenetriamine, hydrochloride (1:2) is C6H11Cl2N3.
What is the molecular weight of 1,2,4-Benzenetriamine, hydrochloride (1:2)?
The molecular weight of 1,2,4-Benzenetriamine, hydrochloride (1:2) is 195.03 g/mol.
Where can I buy 1,2,4-Benzenetriamine, hydrochloride (1:2)?
You can request a quote for 1,2,4-Benzenetriamine, hydrochloride (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Benzenetriamine, hydrochloride (1:2)?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Benzenetriamine, hydrochloride (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.