![2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile structure](/static/products/950/95058-96-1.png)
2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile
TL;DR: 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile (CAS 95058-96-1) is a chemical compound with molecular formula C10H6ClN3 and molecular weight 203.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile
Also Known As: 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile, J3.513.327E, 5,6-trimethylene-2-chloro-3,4-dicyanopyridine, 2-CHLORO-5H,6H,7H-CYCLOPENTA[B]PYRIDINE-3,4-DICARBONITRILE
| Molecular Formula | C10H6ClN3 |
|---|---|
| Molecular Weight | 203.03 g/mol |
| LogP | 1.96706 |
| Topological Polar Surface Area | 60.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.02502 |
| Heavy Atoms | 14 |
| Complexity | 478.8612 |
Chemical Identifiers
| CAS Number | 95058-96-1 |
|---|---|
| SMILES | C1CC2=C(C1)N=C(C(=C2C#N)C#N)Cl |
Product Overview
2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile (CAS 95058-96-1), with molecular formula C10H6ClN3 and molecular weight 203.03 g/mol. IUPAC: 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile.
Chemical Property Profile of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile
Property Insights of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile
The XLogP value of 1.96706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile. The TPSA of 60.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile. Following Lipinski's Rule of Five, 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile has 0 hydrogen bond donor(s) and 3 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 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile?
The CAS number of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile is 95058-96-1.
What is the molecular formula of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile?
The molecular formula of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile is C10H6ClN3.
What is the molecular weight of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile?
The molecular weight of 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile is 203.03 g/mol.
Where can I buy 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile?
You can request a quote for 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.