Butanoic acid, 4-(2-oxocyclopentyl)-
TL;DR: Butanoic acid, 4-(2-oxocyclopentyl)- (CAS 3296-46-6) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-oxocyclopentyl)butanoic acid
Also Known As: 4-(2-Oxocyclopentyl)butanoic acid, Butanoic acid, 4-(2-oxocyclopentyl)-, 4-(2-Oxocyclopentyl)butanoic acid #, 2-(3-carboxypropyl)cyclopentan-1-one
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 3296-46-6 |
|---|---|
| SMILES | C1CC(C(=O)C1)CCCC(=O)O |
| InChIKey | QWRLDLXYFIADDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanoic acid, 4-(2-oxocyclopentyl)- (CAS 3296-46-6), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: 4-(2-oxocyclopentyl)butanoic acid.
Chemical Property Profile of Butanoic acid, 4-(2-oxocyclopentyl)-
Property Insights of Butanoic acid, 4-(2-oxocyclopentyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 4-(2-oxocyclopentyl)-. With a topological polar surface area (TPSA) of 54.4 Ų, Butanoic acid, 4-(2-oxocyclopentyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, 4-(2-oxocyclopentyl)- 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 Butanoic acid, 4-(2-oxocyclopentyl)-?
The CAS number of Butanoic acid, 4-(2-oxocyclopentyl)- is 3296-46-6.
What is the molecular formula of Butanoic acid, 4-(2-oxocyclopentyl)-?
The molecular formula of Butanoic acid, 4-(2-oxocyclopentyl)- is C9H14O3.
What is the molecular weight of Butanoic acid, 4-(2-oxocyclopentyl)-?
The molecular weight of Butanoic acid, 4-(2-oxocyclopentyl)- is 170.09 g/mol.
Where can I buy Butanoic acid, 4-(2-oxocyclopentyl)-?
You can request a quote for Butanoic acid, 4-(2-oxocyclopentyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-(2-oxocyclopentyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-(2-oxocyclopentyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.