1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-
TL;DR: 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- (CAS 40496-54-6) is a chemical compound with molecular formula C15H4Cl4N4 and molecular weight 379.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-6-(3,4-dichloroanilino)benzene-1,3,5-tricarbonitrile
Also Known As: 4,6-Dichloro-2-(3,4-dichloroanilino)trimesonitrile, 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-, 4,6-Dichloro-2-(3,4-dichloroanilino)-1,3,5-benzenetricarbonitrile, 2,4-dichloro-6-[(3,4-dichlorophenyl)amino]benzene-1,3,5-tricarbonitrile, 2,4-dichloro-6-(3,4-dichloroanilino)benzene-1,3,5-tricarbonitrile
| Molecular Formula | C15H4Cl4N4 |
|---|---|
| Molecular Weight | 379.92 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 379.919 |
| Heavy Atoms | 23 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 40496-54-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=C(C(=C(C(=C2C#N)Cl)C#N)Cl)C#N)Cl)Cl |
| InChIKey | SAFCEOPCBZQJEY-UHFFFAOYSA-N |
Product Overview
1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- (CAS 40496-54-6), with molecular formula C15H4Cl4N4 and molecular weight 379.92 g/mol. IUPAC: 2,4-dichloro-6-(3,4-dichloroanilino)benzene-1,3,5-tricarbonitrile.
Chemical Property Profile of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-
Property Insights of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-
The XLogP value of 5.7 indicates that 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-. Following Lipinski's Rule of Five, 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-?
The CAS number of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- is 40496-54-6.
What is the molecular formula of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-?
The molecular formula of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- is C15H4Cl4N4.
What is the molecular weight of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-?
The molecular weight of 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- is 379.92 g/mol.
Where can I buy 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-?
You can request a quote for 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.