1,1-Dichloro-1-fluoropentan-2-ol
TL;DR: 1,1-Dichloro-1-fluoropentan-2-ol (CAS 6963-17-3) is a chemical compound with molecular formula C5H9Cl2FO and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dichloro-1-fluoropentan-2-ol
Also Known As: 1,1-dichloro-1-fluoropentan-2-ol, 1,1-DICHLORO-1-FLUORO-PENTAN-2-OL, 2-Pentanol,1,1-dichloro-1-fluoro-, KST-1B7724
| Molecular Formula | C5H9Cl2FO |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.00145 |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 6963-17-3 |
|---|---|
| SMILES | CCCC(C(F)(Cl)Cl)O |
| InChIKey | UNJLBMRUWYLAQQ-UHFFFAOYSA-N |
Product Overview
1,1-Dichloro-1-fluoropentan-2-ol (CAS 6963-17-3), with molecular formula C5H9Cl2FO and molecular weight 174.00 g/mol. IUPAC: 1,1-dichloro-1-fluoropentan-2-ol.
Chemical Property Profile of 1,1-Dichloro-1-fluoropentan-2-ol
Property Insights of 1,1-Dichloro-1-fluoropentan-2-ol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dichloro-1-fluoropentan-2-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 1,1-Dichloro-1-fluoropentan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dichloro-1-fluoropentan-2-ol has 1 hydrogen bond donor(s) and 2 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 1,1-Dichloro-1-fluoropentan-2-ol?
The CAS number of 1,1-Dichloro-1-fluoropentan-2-ol is 6963-17-3.
What is the molecular formula of 1,1-Dichloro-1-fluoropentan-2-ol?
The molecular formula of 1,1-Dichloro-1-fluoropentan-2-ol is C5H9Cl2FO.
What is the molecular weight of 1,1-Dichloro-1-fluoropentan-2-ol?
The molecular weight of 1,1-Dichloro-1-fluoropentan-2-ol is 174.00 g/mol.
Where can I buy 1,1-Dichloro-1-fluoropentan-2-ol?
You can request a quote for 1,1-Dichloro-1-fluoropentan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dichloro-1-fluoropentan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dichloro-1-fluoropentan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.