Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-
TL;DR: Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- (CAS 113983-94-1) is a chemical compound with molecular formula C11H5ClN4 and molecular weight 228.02028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chloro-1H-quinoxalin-2-ylidene)propanedinitrile
Also Known As: 2-(3-chloro-1,2-dihydroquinoxalin-2-ylidene)propanedinitrile, 2-(3-chloro-1H-quinoxalin-2-ylidene)propanedinitrile, 2-(3-chloroquinoxalin-2(1H)-ylidene)malononitrile, Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-, (3-chloroquinoxalin-2(1H)-ylidene)propanedinitrile
Technical Specifications
| Molecular Formula | C11H5ClN4 |
| Molecular Weight | 228.02028 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.02028 Da |
| Heavy Atoms | 16 |
| Complexity | 441.0 |
| SMILES | C1=CC=C2C(=C1)NC(=C(C#N)C#N)C(=N2)Cl |
| InChIKey | AQJRBPLUJNFYKW-UHFFFAOYSA-N |
Chemical Property Profile of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-
Property Insights of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-. Following Lipinski's Rule of Five, Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- 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
What is the CAS number of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-?
The CAS number of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- is 113983-94-1.
What is the molecular formula of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-?
The molecular formula of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- is C11H5ClN4.
What is the molecular weight of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-?
The molecular weight of Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- is 228.02028 g/mol.
Where can I buy Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-?
You can request a quote for Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)-?
Yes, CoreyChem provides custom synthesis services for Propanedinitrile, (3-chloro-2(1H)-quinoxalinylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.