Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-
TL;DR: Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- (CAS 110983-29-4) is a chemical compound with molecular formula C11H4Cl2N4 and molecular weight 261.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichloroanilino)ethene-1,1,2-tricarbonitrile
Also Known As: (3,4-Dichloranilino)ethenetricarbonitrile, Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-, ((3,4-Dichlorophenyl)amino)ethenetricarbonitrile, 2-(3,4-dichloroanilino)ethene-1,1,2-tricarbonitrile, (3,4-Dichloroanilino)ethene-1,1,2-tricarbonitrile
| Molecular Formula | C11H4Cl2N4 |
|---|---|
| Molecular Weight | 261.98 g/mol |
| LogP | 3.23014 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.9813 |
| Heavy Atoms | 17 |
| Complexity | 583.36816 |
Chemical Identifiers
| CAS Number | 110983-29-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=C(C#N)C#N)C#N)Cl)Cl |
Product Overview
Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- (CAS 110983-29-4), with molecular formula C11H4Cl2N4 and molecular weight 261.98 g/mol. IUPAC: 2-(3,4-dichloroanilino)ethene-1,1,2-tricarbonitrile.
Chemical Property Profile of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-
Property Insights of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-
The XLogP value of 3.23014 indicates that Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- 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 Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-. Following Lipinski's Rule of Five, Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- has 1 hydrogen bond donor(s) and 4 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 Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-?
The CAS number of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- is 110983-29-4.
What is the molecular formula of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-?
The molecular formula of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- is C11H4Cl2N4.
What is the molecular weight of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-?
The molecular weight of Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- is 261.98 g/mol.
Where can I buy Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-?
You can request a quote for Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Ethenetricarbonitrile, ((3,4-dichlorophenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.