2-Pyren-2-yloxirane
TL;DR: 2-Pyren-2-yloxirane (CAS 86470-96-4) 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-2-yloxirane
Also Known As: 2-pyren-2-yloxirane, 2-oxiranylpyrene, 2-(pyren-2-yl)oxirane
| 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 | 339.0 |
Chemical Identifiers
| CAS Number | 86470-96-4 |
|---|---|
| SMILES | C1C(O1)C2=CC3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3 |
| InChIKey | NQKVUDJVWOUUQF-UHFFFAOYSA-N |
Product Overview
2-Pyren-2-yloxirane (CAS 86470-96-4), with molecular formula C18H12O and molecular weight 244.09 g/mol. IUPAC: 2-pyren-2-yloxirane.
Chemical Property Profile of 2-Pyren-2-yloxirane
Property Insights of 2-Pyren-2-yloxirane
The XLogP value of 4.5 indicates that 2-Pyren-2-yloxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 2-Pyren-2-yloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyren-2-yloxirane 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 2-Pyren-2-yloxirane?
The CAS number of 2-Pyren-2-yloxirane is 86470-96-4.
What is the molecular formula of 2-Pyren-2-yloxirane?
The molecular formula of 2-Pyren-2-yloxirane is C18H12O.
What is the molecular weight of 2-Pyren-2-yloxirane?
The molecular weight of 2-Pyren-2-yloxirane is 244.09 g/mol.
Where can I buy 2-Pyren-2-yloxirane?
You can request a quote for 2-Pyren-2-yloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyren-2-yloxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyren-2-yloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.