1-(2-Chloroethyl)cyclopentanecarbonitrile
TL;DR: 1-(2-Chloroethyl)cyclopentanecarbonitrile (CAS 148614-12-4) is a chemical compound with molecular formula C8H12ClN and molecular weight 157.06583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloroethyl)cyclopentane-1-carbonitrile
Also Known As: 1-(2-chloroethyl)cyclopentanecarbonitrile, 1-(2-chloroethyl)cyclopentane-1-carbonitrile
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H12ClN |
| Molecular Weight | 157.06583 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.06583 Da |
| Heavy Atoms | 10 |
| Complexity | 150.0 |
| SMILES | C1CCC(C1)(CCCl)C#N |
| InChIKey | RKRJJQMWCGDZIG-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Chloroethyl)cyclopentanecarbonitrile
Property Insights of 1-(2-Chloroethyl)cyclopentanecarbonitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)cyclopentanecarbonitrile. With a topological polar surface area (TPSA) of 23.8 Ų, 1-(2-Chloroethyl)cyclopentanecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)cyclopentanecarbonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-Chloroethyl)cyclopentanecarbonitrile?
The CAS number of 1-(2-Chloroethyl)cyclopentanecarbonitrile is 148614-12-4.
What is the molecular formula of 1-(2-Chloroethyl)cyclopentanecarbonitrile?
The molecular formula of 1-(2-Chloroethyl)cyclopentanecarbonitrile is C8H12ClN.
What is the molecular weight of 1-(2-Chloroethyl)cyclopentanecarbonitrile?
The molecular weight of 1-(2-Chloroethyl)cyclopentanecarbonitrile is 157.06583 g/mol.
Where can I buy 1-(2-Chloroethyl)cyclopentanecarbonitrile?
You can request a quote for 1-(2-Chloroethyl)cyclopentanecarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Chloroethyl)cyclopentanecarbonitrile?
Yes, CoreyChem provides custom synthesis services for 1-(2-Chloroethyl)cyclopentanecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.