4-Pyrenyloxirane
TL;DR: 4-Pyrenyloxirane (CAS 73529-24-5) is a chemical compound with molecular formula C18H12O and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyren-4-yloxirane
Also Known As: 4-Pyrenyloxirane, Oxirane, 4-pyrenyl-, Pyrene, 4-epoxyethyl-, 2-pyren-4-yloxirane, Oxirane, 2-(4-pyrenyl)-
| Molecular Formula | C18H12O |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.08882 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 73529-24-5 |
|---|---|
| SMILES | C1C(O1)C2=CC3=CC=CC4=C3C5=C(C=CC=C25)C=C4 |
| InChIKey | ZPLRRRIERPCHAT-UHFFFAOYSA-N |
Product Overview
4-Pyrenyloxirane (CAS 73529-24-5), with molecular formula C18H12O and molecular weight 244.09 g/mol. IUPAC: 2-pyren-4-yloxirane.
Chemical Property Profile of 4-Pyrenyloxirane
Property Insights of 4-Pyrenyloxirane
The XLogP value of 4.5 indicates that 4-Pyrenyloxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 4-Pyrenyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyrenyloxirane has 0 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-Pyrenyloxirane?
The CAS number of 4-Pyrenyloxirane is 73529-24-5.
What is the molecular formula of 4-Pyrenyloxirane?
The molecular formula of 4-Pyrenyloxirane is C18H12O.
What is the molecular weight of 4-Pyrenyloxirane?
The molecular weight of 4-Pyrenyloxirane is 244.09 g/mol.
Where can I buy 4-Pyrenyloxirane?
You can request a quote for 4-Pyrenyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrenyloxirane?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrenyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.