5-Fluoropentyl thiocyanate
TL;DR: 5-Fluoropentyl thiocyanate (CAS 661-18-7) is a chemical compound with molecular formula C6H10FNS and molecular weight 147.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoropentyl thiocyanate
Also Known As: 5-Fluoropentyl thiocyanate, 5-Fluoroamyl thiocyanate, 5-Fluor-pentylthiocyanat, Thiocyanicacid5-fluoropentylester, 5-fluoro-pentylsulfanyl cyanate
| Molecular Formula | C6H10FNS |
|---|---|
| Molecular Weight | 147.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 147.0518 |
| Heavy Atoms | 9 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 661-18-7 |
|---|---|
| SMILES | C(CCF)CCSC#N |
| InChIKey | QHACRDBQKDNTBY-UHFFFAOYSA-N |
Product Overview
5-Fluoropentyl thiocyanate (CAS 661-18-7), with molecular formula C6H10FNS and molecular weight 147.05 g/mol. IUPAC: 5-fluoropentyl thiocyanate.
Chemical Property Profile of 5-Fluoropentyl thiocyanate
Property Insights of 5-Fluoropentyl thiocyanate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoropentyl thiocyanate. With a topological polar surface area (TPSA) of 49.1 Ų, 5-Fluoropentyl thiocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoropentyl thiocyanate 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 5-Fluoropentyl thiocyanate?
The CAS number of 5-Fluoropentyl thiocyanate is 661-18-7.
What is the molecular formula of 5-Fluoropentyl thiocyanate?
The molecular formula of 5-Fluoropentyl thiocyanate is C6H10FNS.
What is the molecular weight of 5-Fluoropentyl thiocyanate?
The molecular weight of 5-Fluoropentyl thiocyanate is 147.05 g/mol.
Where can I buy 5-Fluoropentyl thiocyanate?
You can request a quote for 5-Fluoropentyl thiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoropentyl thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoropentyl thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.