5-Oxo-1-cyclopentene-1-heptanoic acid
TL;DR: 5-Oxo-1-cyclopentene-1-heptanoic acid (CAS 5239-43-0) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(5-oxocyclopenten-1-yl)heptanoic acid
Also Known As: 5-Oxocyclopent-1-ene-1-heptanoic acid, 5-Oxo-1-cyclopentene-1-heptanoic acid, starbld0002130, 7-(5-oxocyclopenten-1-yl)heptanoic acid, 1-Cyclopentene-1-heptanoic acid, 5-oxo-
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 5239-43-0 |
|---|---|
| SMILES | C1CC(=O)C(=C1)CCCCCCC(=O)O |
| InChIKey | LBOKTHVXIPFAJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Oxo-1-cyclopentene-1-heptanoic acid (CAS 5239-43-0), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 7-(5-oxocyclopenten-1-yl)heptanoic acid.
Chemical Property Profile of 5-Oxo-1-cyclopentene-1-heptanoic acid
Property Insights of 5-Oxo-1-cyclopentene-1-heptanoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Oxo-1-cyclopentene-1-heptanoic acid. With a topological polar surface area (TPSA) of 54.4 Ų, 5-Oxo-1-cyclopentene-1-heptanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Oxo-1-cyclopentene-1-heptanoic acid has 1 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 5-Oxo-1-cyclopentene-1-heptanoic acid?
The CAS number of 5-Oxo-1-cyclopentene-1-heptanoic acid is 5239-43-0.
What is the molecular formula of 5-Oxo-1-cyclopentene-1-heptanoic acid?
The molecular formula of 5-Oxo-1-cyclopentene-1-heptanoic acid is C12H18O3.
What is the molecular weight of 5-Oxo-1-cyclopentene-1-heptanoic acid?
The molecular weight of 5-Oxo-1-cyclopentene-1-heptanoic acid is 210.13 g/mol.
Where can I buy 5-Oxo-1-cyclopentene-1-heptanoic acid?
You can request a quote for 5-Oxo-1-cyclopentene-1-heptanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Oxo-1-cyclopentene-1-heptanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Oxo-1-cyclopentene-1-heptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.