4-Pyrenol
TL;DR: 4-Pyrenol (CAS 31700-39-7) is a chemical compound with molecular formula C16H10O and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyren-4-ol
Also Known As: 4-Pyrenol, pyren-4-ol, 4-hydroxypyrene, 4-Hydroxy-pyren, RefChem:100438
| Molecular Formula | C16H10O |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.07317 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 31700-39-7 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)O |
| InChIKey | OYWUCVHMVXHBFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Pyrenol (CAS 31700-39-7), with molecular formula C16H10O and molecular weight 218.07 g/mol. IUPAC: pyren-4-ol.
Chemical Property Profile of 4-Pyrenol
Property Insights of 4-Pyrenol
The XLogP value of 4.7 indicates that 4-Pyrenol 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-Pyrenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyrenol has 1 hydrogen bond donor(s) and 1 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 4-Pyrenol?
The CAS number of 4-Pyrenol is 31700-39-7.
What is the molecular formula of 4-Pyrenol?
The molecular formula of 4-Pyrenol is C16H10O.
What is the molecular weight of 4-Pyrenol?
The molecular weight of 4-Pyrenol is 218.07 g/mol.
Where can I buy 4-Pyrenol?
You can request a quote for 4-Pyrenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.