2,4-Diaminodiphenylamine
TL;DR: 2,4-Diaminodiphenylamine (CAS 136-17-4) is a chemical compound with molecular formula C12H13N3 and molecular weight 199.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-phenylbenzene-1,2,4-triamine
Also Known As: 2,4-Diaminodiphenylamine, N1-phenylbenzene-1,2,4-triamine, Diphenylamine, 2,4-diamino-, 1-N-phenylbenzene-1,2,4-triamine, 1,2,4-Benzenetriamine, N'-phenyl-
| Molecular Formula | C12H13N3 |
|---|---|
| Molecular Weight | 199.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.11095 |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 136-17-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)N |
| InChIKey | VOSLIUIVGWBSOK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Diaminodiphenylamine (CAS 136-17-4), with molecular formula C12H13N3 and molecular weight 199.11 g/mol. IUPAC: 1-N-phenylbenzene-1,2,4-triamine.
Chemical Property Profile of 2,4-Diaminodiphenylamine
Property Insights of 2,4-Diaminodiphenylamine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diaminodiphenylamine. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diaminodiphenylamine. Following Lipinski's Rule of Five, 2,4-Diaminodiphenylamine has 3 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 2,4-Diaminodiphenylamine?
The CAS number of 2,4-Diaminodiphenylamine is 136-17-4.
What is the molecular formula of 2,4-Diaminodiphenylamine?
The molecular formula of 2,4-Diaminodiphenylamine is C12H13N3.
What is the molecular weight of 2,4-Diaminodiphenylamine?
The molecular weight of 2,4-Diaminodiphenylamine is 199.11 g/mol.
Where can I buy 2,4-Diaminodiphenylamine?
You can request a quote for 2,4-Diaminodiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diaminodiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diaminodiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.