3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile
TL;DR: 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile (CAS 90771-89-4) is a chemical compound with molecular formula C10H8N4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propylcyclopropane-1,1,2,2-tetracarbonitrile
Also Known As: 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile, 3-propylcyclopropane-1,1,2,2-tetracarbonitrile, 3-n-propyl-1,1,2,2-tetracyanopropane, J1.322.089A, PROPYL-1,1,2,2-CYCLOPROPANETETRACARBONITRILE
| Molecular Formula | C10H8N4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.07489 |
| Heavy Atoms | 14 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 90771-89-4 |
|---|---|
| SMILES | CCCC1C(C1(C#N)C#N)(C#N)C#N |
| InChIKey | JRUVRPIGBHDROS-UHFFFAOYSA-N |
Product Overview
3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile (CAS 90771-89-4), with molecular formula C10H8N4 and molecular weight 184.07 g/mol. IUPAC: 3-propylcyclopropane-1,1,2,2-tetracarbonitrile.
Chemical Property Profile of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile
Property Insights of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile. Following Lipinski's Rule of Five, 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile 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
Frequently Asked Questions
What is the CAS number of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile?
The CAS number of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile is 90771-89-4.
What is the molecular formula of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile?
The molecular formula of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile is C10H8N4.
What is the molecular weight of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile?
The molecular weight of 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile is 184.07 g/mol.
Where can I buy 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile?
You can request a quote for 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Propyl-1,1,2,2-cyclopropanetetracarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.