1-Acetylpyrene
TL;DR: 1-Acetylpyrene (CAS 3264-21-9) 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.
1-pyren-1-ylethanone
Also Known As: 1-Acetylpyrene, 1-(Pyren-1-yl)ethanone, 1-pyren-1-ylethanone, Ethanone, 1-(1-pyrenyl)-, acetylpyrene
| Molecular Formula | C18H12O |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.08882 |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 3264-21-9 |
|---|---|
| SMILES | CC(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1 |
| InChIKey | KCIJNJVCFPSUBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Acetylpyrene (CAS 3264-21-9), with molecular formula C18H12O and molecular weight 244.09 g/mol. IUPAC: 1-pyren-1-ylethanone.
Chemical Property Profile of 1-Acetylpyrene
Property Insights of 1-Acetylpyrene
The XLogP value of 4.7 indicates that 1-Acetylpyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Acetylpyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetylpyrene 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 1-Acetylpyrene?
The CAS number of 1-Acetylpyrene is 3264-21-9.
What is the molecular formula of 1-Acetylpyrene?
The molecular formula of 1-Acetylpyrene is C18H12O.
What is the molecular weight of 1-Acetylpyrene?
The molecular weight of 1-Acetylpyrene is 244.09 g/mol.
Where can I buy 1-Acetylpyrene?
You can request a quote for 1-Acetylpyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetylpyrene?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetylpyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.