Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-
TL;DR: Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- (CAS 1518-15-6) is a chemical compound with molecular formula C12H8N4 and molecular weight 208.07489 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(dicyanomethylidene)cyclohexylidene]propanedinitrile
Also Known As: 1,4-Bis(dicyanomethylene)cyclohexane, (1,4-Cyclohexanediylidene)-dimalononitrile, -DIMALONONITRILE, Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-, (Cyclohexane-1,4-diylidene)dimalononitrile
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H8N4 |
| Molecular Weight | 208.07489 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.07489 Da |
| Heavy Atoms | 16 |
| Complexity | 465.0 |
| SMILES | C1CC(=C(C#N)C#N)CCC1=C(C#N)C#N |
| InChIKey | NXQNMVFWIRBUHX-UHFFFAOYSA-N |
Chemical Property Profile of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-
Property Insights of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-. Following Lipinski's Rule of Five, Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- has 0 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, 2,2'-(1,4-cyclohexanediylidene)bis-?
The CAS number of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- is 1518-15-6.
What is the molecular formula of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-?
The molecular formula of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- is C12H8N4.
What is the molecular weight of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-?
The molecular weight of Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- is 208.07489 g/mol.
Where can I buy Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-?
You can request a quote for Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis-?
Yes, CoreyChem provides custom synthesis services for Propanedinitrile, 2,2'-(1,4-cyclohexanediylidene)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.