![Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- structure](/static/products/1063/106345-06-6.webp)
Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-
TL;DR: Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- (CAS 106345-06-6) is a chemical compound with molecular formula C9H8N4 and molecular weight 172.07489 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(cyanomethyl)pyrrolidin-2-ylidene]propanedinitrile
Also Known As: 2-[1-(cyanomethyl)pyrrolidin-2-ylidene]propanedinitrile, 4-nitrobenzyl-6-phenyl-2-hexynoate, Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-, AH-262/34230021, [1-(cyanomethyl)pyrrolidin-2-ylidene]propanedinitrile
Technical Specifications
| Molecular Formula | C9H8N4 |
| Molecular Weight | 172.07489 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.07489 Da |
| Heavy Atoms | 13 |
| Complexity | 360.0 |
| SMILES | C1CC(=C(C#N)C#N)N(C1)CC#N |
| InChIKey | RWQPISWIADJOQN-UHFFFAOYSA-N |
Chemical Property Profile of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-
Property Insights of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-. Following Lipinski's Rule of Five, Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- 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, [1-(cyanomethyl)-2-pyrrolidinylidene]-?
The CAS number of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- is 106345-06-6.
What is the molecular formula of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-?
The molecular formula of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- is C9H8N4.
What is the molecular weight of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-?
The molecular weight of Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- is 172.07489 g/mol.
Where can I buy Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-?
You can request a quote for Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]-?
Yes, CoreyChem provides custom synthesis services for Propanedinitrile, [1-(cyanomethyl)-2-pyrrolidinylidene]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.