2,3,4,5,6-Pentafluorobenzhydryl alcohol
TL;DR: 2,3,4,5,6-Pentafluorobenzhydryl alcohol (CAS 1944-05-4) is a chemical compound with molecular formula C13H7F5O and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentafluorophenyl)-phenylmethanol
Also Known As: 2,3,4,5,6-Pentafluorobenzhydrol, PENTAFLUOROBENZHYDROL, (pentafluorophenyl)(phenyl)methanol, (perfluorophenyl)(phenyl)methanol, KST-1A0001
| Molecular Formula | C13H7F5O |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.04172 |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 1944-05-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=C(C(=C(C(=C2F)F)F)F)F)O |
| InChIKey | PMIIFKURPQGSMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4,5,6-Pentafluorobenzhydryl alcohol (CAS 1944-05-4), with molecular formula C13H7F5O and molecular weight 274.04 g/mol. IUPAC: (2,3,4,5,6-pentafluorophenyl)-phenylmethanol.
Chemical Property Profile of 2,3,4,5,6-Pentafluorobenzhydryl alcohol
Property Insights of 2,3,4,5,6-Pentafluorobenzhydryl alcohol
The XLogP value of 3.2 indicates that 2,3,4,5,6-Pentafluorobenzhydryl alcohol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,3,4,5,6-Pentafluorobenzhydryl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5,6-Pentafluorobenzhydryl alcohol 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 2,3,4,5,6-Pentafluorobenzhydryl alcohol?
The CAS number of 2,3,4,5,6-Pentafluorobenzhydryl alcohol is 1944-05-4.
What is the molecular formula of 2,3,4,5,6-Pentafluorobenzhydryl alcohol?
The molecular formula of 2,3,4,5,6-Pentafluorobenzhydryl alcohol is C13H7F5O.
What is the molecular weight of 2,3,4,5,6-Pentafluorobenzhydryl alcohol?
The molecular weight of 2,3,4,5,6-Pentafluorobenzhydryl alcohol is 274.04 g/mol.
Where can I buy 2,3,4,5,6-Pentafluorobenzhydryl alcohol?
You can request a quote for 2,3,4,5,6-Pentafluorobenzhydryl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5,6-Pentafluorobenzhydryl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5,6-Pentafluorobenzhydryl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.