Piperonyl cyclonene
TL;DR: Piperonyl cyclonene (CAS 119-89-1) is a chemical compound with molecular formula C19H24O3 and molecular weight 300.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-yl)-3-hexylcyclohex-2-en-1-one
Also Known As: PIPERONYL CYCLONENE, Piperonylcyklonen, Piperonylcyklonen [Czech], PIPERONYL CYCLOHEXENONE, 5-(1,3-benzodioxol-5-yl)-3-hexylcyclohex-2-en-1-one
| Molecular Formula | C19H24O3 |
|---|---|
| Molecular Weight | 300.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 300.17255 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 119-89-1 |
|---|---|
| SMILES | CCCCCCC1=CC(=O)CC(C1)C2=CC3=C(C=C2)OCO3 |
| InChIKey | JBVNWTXRFKZNBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperonyl cyclonene (CAS 119-89-1), with molecular formula C19H24O3 and molecular weight 300.17 g/mol. IUPAC: 5-(1,3-benzodioxol-5-yl)-3-hexylcyclohex-2-en-1-one.
Chemical Property Profile of Piperonyl cyclonene
Property Insights of Piperonyl cyclonene
The XLogP value of 4.6 indicates that Piperonyl cyclonene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Piperonyl cyclonene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperonyl cyclonene has 0 hydrogen bond donor(s) and 3 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 Piperonyl cyclonene?
The CAS number of Piperonyl cyclonene is 119-89-1.
What is the molecular formula of Piperonyl cyclonene?
The molecular formula of Piperonyl cyclonene is C19H24O3.
What is the molecular weight of Piperonyl cyclonene?
The molecular weight of Piperonyl cyclonene is 300.17 g/mol.
Where can I buy Piperonyl cyclonene?
You can request a quote for Piperonyl cyclonene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperonyl cyclonene?
Yes, KEHONG BIO provides custom synthesis services for Piperonyl cyclonene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.