1-(Pentafluorophenyl)-2-propanol
TL;DR: 1-(Pentafluorophenyl)-2-propanol (CAS 1988-60-9) is a chemical compound with molecular formula C9H7F5O and molecular weight 226.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3,4,5,6-pentafluorophenyl)propan-2-ol
Also Known As: 1-(Pentafluorophenyl)-2-propanol, 1-(pentafluorophenyl)propan-2-ol, 1-(2,3,4,5,6-pentafluorophenyl)propan-2-ol, 1-(Perfluorophenyl)propan-2-ol, KST-1B1453
| Molecular Formula | C9H7F5O |
|---|---|
| Molecular Weight | 226.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.0417 |
| Heavy Atoms | 15 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 1988-60-9 |
|---|---|
| SMILES | CC(CC1=C(C(=C(C(=C1F)F)F)F)F)O |
| InChIKey | VENFBZQYBFCNLS-UHFFFAOYSA-N |
Product Overview
1-(Pentafluorophenyl)-2-propanol (CAS 1988-60-9), with molecular formula C9H7F5O and molecular weight 226.04 g/mol. IUPAC: 1-(2,3,4,5,6-pentafluorophenyl)propan-2-ol.
Chemical Property Profile of 1-(Pentafluorophenyl)-2-propanol
Property Insights of 1-(Pentafluorophenyl)-2-propanol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Pentafluorophenyl)-2-propanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-(Pentafluorophenyl)-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Pentafluorophenyl)-2-propanol has 1 hydrogen bond donor(s) and 6 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-(Pentafluorophenyl)-2-propanol?
The CAS number of 1-(Pentafluorophenyl)-2-propanol is 1988-60-9.
What is the molecular formula of 1-(Pentafluorophenyl)-2-propanol?
The molecular formula of 1-(Pentafluorophenyl)-2-propanol is C9H7F5O.
What is the molecular weight of 1-(Pentafluorophenyl)-2-propanol?
The molecular weight of 1-(Pentafluorophenyl)-2-propanol is 226.04 g/mol.
Where can I buy 1-(Pentafluorophenyl)-2-propanol?
You can request a quote for 1-(Pentafluorophenyl)-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Pentafluorophenyl)-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Pentafluorophenyl)-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.