2,4-Dicyanoaniline
TL;DR: 2,4-Dicyanoaniline (CAS 19619-22-8) is a chemical compound with molecular formula C8H5N3 and molecular weight 143.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-aminobenzene-1,3-dicarbonitrile
Also Known As: 2,4-Dicyanoaniline, 4-aminoisophthalonitrile, 4-aminobenzene-1,3-dicarbonitrile, 2.4-dicyanoaniline, 1-amino-2,4-dicyanobenzene
| Molecular Formula | C8H5N3 |
|---|---|
| Molecular Weight | 143.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 143.04834 |
| Heavy Atoms | 11 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 19619-22-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C#N)C#N)N |
| InChIKey | IPMNLGOBXWTQRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dicyanoaniline (CAS 19619-22-8), with molecular formula C8H5N3 and molecular weight 143.05 g/mol. IUPAC: 4-aminobenzene-1,3-dicarbonitrile.
Chemical Property Profile of 2,4-Dicyanoaniline
Property Insights of 2,4-Dicyanoaniline
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dicyanoaniline. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dicyanoaniline. Following Lipinski's Rule of Five, 2,4-Dicyanoaniline 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 2,4-Dicyanoaniline?
The CAS number of 2,4-Dicyanoaniline is 19619-22-8.
What is the molecular formula of 2,4-Dicyanoaniline?
The molecular formula of 2,4-Dicyanoaniline is C8H5N3.
What is the molecular weight of 2,4-Dicyanoaniline?
The molecular weight of 2,4-Dicyanoaniline is 143.05 g/mol.
Where can I buy 2,4-Dicyanoaniline?
You can request a quote for 2,4-Dicyanoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dicyanoaniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dicyanoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.