1-Ethenylpyrene
TL;DR: 1-Ethenylpyrene (CAS 17088-21-0) is a chemical compound with molecular formula C18H12 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenylpyrene
Also Known As: 1-Vinylpyrene, 1-Ethenylpyrene, 3-Vinylpyrene, Pyrene, 1-ethenyl-, Pyrene, 3-vinyl-
| Molecular Formula | C18H12 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.0939 |
| Heavy Atoms | 18 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 17088-21-0 |
|---|---|
| SMILES | C=CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1 |
| InChIKey | WPMHMYHJGDAHKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethenylpyrene (CAS 17088-21-0), with molecular formula C18H12 and molecular weight 228.09 g/mol. IUPAC: 1-ethenylpyrene.
Chemical Property Profile of 1-Ethenylpyrene
Property Insights of 1-Ethenylpyrene
The XLogP value of 5.8 indicates that 1-Ethenylpyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Ethenylpyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethenylpyrene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Ethenylpyrene?
The CAS number of 1-Ethenylpyrene is 17088-21-0.
What is the molecular formula of 1-Ethenylpyrene?
The molecular formula of 1-Ethenylpyrene is C18H12.
What is the molecular weight of 1-Ethenylpyrene?
The molecular weight of 1-Ethenylpyrene is 228.09 g/mol.
Where can I buy 1-Ethenylpyrene?
You can request a quote for 1-Ethenylpyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethenylpyrene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethenylpyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.