1-(4-Fluorophenyl)cyclopentanecarbonitrile
TL;DR: 1-(4-Fluorophenyl)cyclopentanecarbonitrile (CAS 83706-50-7) is a chemical compound with molecular formula C12H12FN and molecular weight 189.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)cyclopentane-1-carbonitrile
Also Known As: 1-(4-Fluorophenyl)cyclopentanecarbonitrile, 1-(4-fluorophenyl)cyclopentane-1-carbonitrile, EINECS 280-526-7, 1- CYCLOPENTANECARBONITRILE, Cyclopentanecarbonitrile,1-(4-fluorophenyl)-
| Molecular Formula | C12H12FN |
|---|---|
| Molecular Weight | 189.10 g/mol |
| LogP | 3.16108 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.09538 |
| Heavy Atoms | 14 |
| Complexity | 354.90326 |
Chemical Identifiers
| CAS Number | 83706-50-7 |
|---|---|
| SMILES | C1CCC(C1)(C#N)C2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorophenyl)cyclopentanecarbonitrile (CAS 83706-50-7), with molecular formula C12H12FN and molecular weight 189.10 g/mol. IUPAC: 1-(4-fluorophenyl)cyclopentane-1-carbonitrile.
Chemical Property Profile of 1-(4-Fluorophenyl)cyclopentanecarbonitrile
Property Insights of 1-(4-Fluorophenyl)cyclopentanecarbonitrile
The XLogP value of 3.16108 indicates that 1-(4-Fluorophenyl)cyclopentanecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 1-(4-Fluorophenyl)cyclopentanecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)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
Frequently Asked Questions
What is the CAS number of 1-(4-Fluorophenyl)cyclopentanecarbonitrile?
The CAS number of 1-(4-Fluorophenyl)cyclopentanecarbonitrile is 83706-50-7.
What is the molecular formula of 1-(4-Fluorophenyl)cyclopentanecarbonitrile?
The molecular formula of 1-(4-Fluorophenyl)cyclopentanecarbonitrile is C12H12FN.
What is the molecular weight of 1-(4-Fluorophenyl)cyclopentanecarbonitrile?
The molecular weight of 1-(4-Fluorophenyl)cyclopentanecarbonitrile is 189.10 g/mol.
Where can I buy 1-(4-Fluorophenyl)cyclopentanecarbonitrile?
You can request a quote for 1-(4-Fluorophenyl)cyclopentanecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenyl)cyclopentanecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)cyclopentanecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.