4-(Pentadecafluoroheptyl)phenol
TL;DR: 4-(Pentadecafluoroheptyl)phenol (CAS 57578-99-1) is a chemical compound with molecular formula C13H5F15O and molecular weight 462.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)phenol
Also Known As: 4-(pentadecafluoroheptyl)phenol, 4-(Perfluoroheptyl)phenol, 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)pheno, 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)phenol
| Molecular Formula | C13H5F15O |
|---|---|
| Molecular Weight | 462.01 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.0101 |
| Heavy Atoms | 29 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 57578-99-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O |
| InChIKey | VQKFCIOCKPQCJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Pentadecafluoroheptyl)phenol (CAS 57578-99-1), with molecular formula C13H5F15O and molecular weight 462.01 g/mol. IUPAC: 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)phenol.
Chemical Property Profile of 4-(Pentadecafluoroheptyl)phenol
Property Insights of 4-(Pentadecafluoroheptyl)phenol
The XLogP value of 6.5 indicates that 4-(Pentadecafluoroheptyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-(Pentadecafluoroheptyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Pentadecafluoroheptyl)phenol has 1 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Pentadecafluoroheptyl)phenol?
The CAS number of 4-(Pentadecafluoroheptyl)phenol is 57578-99-1.
What is the molecular formula of 4-(Pentadecafluoroheptyl)phenol?
The molecular formula of 4-(Pentadecafluoroheptyl)phenol is C13H5F15O.
What is the molecular weight of 4-(Pentadecafluoroheptyl)phenol?
The molecular weight of 4-(Pentadecafluoroheptyl)phenol is 462.01 g/mol.
Where can I buy 4-(Pentadecafluoroheptyl)phenol?
You can request a quote for 4-(Pentadecafluoroheptyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Pentadecafluoroheptyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Pentadecafluoroheptyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.