Isojasmone
TL;DR: Isojasmone (CAS 11050-62-7) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-pent-2-enylcyclopent-2-en-1-one
Also Known As: Isojasmone, Dihydro isojasmonate, 2-Methyl-3-pent-2-enylcyclopent-2-enone, 2-Cyclopenten-1-one, 2-methyl-3-(2-pentenyl)-, 2-methyl-3-[(E)-pent-2-enyl]cyclopent-2-en-1-one
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 233.0 |
| Density | 0.917-0.924 |
| Solubility | insoluble in water; soluble in hexane and fats |
| Refractive Index | 1.472-1.477 |
Chemical Identifiers
| CAS Number | 11050-62-7 |
|---|---|
| SMILES | CCC=CCC1=C(C(=O)CC1)C |
| InChIKey | GVONPEQEUQYVNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isojasmone (CAS 11050-62-7), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 2-methyl-3-pent-2-enylcyclopent-2-en-1-one.
Chemical Property Profile of Isojasmone
Property Insights of Isojasmone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isojasmone. With a topological polar surface area (TPSA) of 17.1 Ų, Isojasmone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isojasmone 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 Isojasmone?
The CAS number of Isojasmone is 11050-62-7.
What is the molecular formula of Isojasmone?
The molecular formula of Isojasmone is C11H16O.
What is the molecular weight of Isojasmone?
The molecular weight of Isojasmone is 164.12 g/mol.
Where can I buy Isojasmone?
You can request a quote for Isojasmone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isojasmone?
Yes, KEHONG BIO provides custom synthesis services for Isojasmone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.