[1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid
TL;DR: [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid (CAS 7229-18-7) is a chemical compound with molecular formula C10H14O5 and molecular weight 214.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-ethoxycarbonyl-2-oxocyclopentyl)acetic acid
Also Known As: KST-1A7839, [1-(ethoxycarbonyl)-2-oxocyclopentyl]acetic acid, 2-(1-ethoxycarbonyl-2-oxocyclopentyl)acetic acid, NCI60_004099, (1-(ethoxycarbonyl)-2-oxocyclopentyl)acetic acid
| Molecular Formula | C10H14O5 |
|---|---|
| Molecular Weight | 214.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.08412 |
| Heavy Atoms | 15 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 7229-18-7 |
|---|---|
| SMILES | CCOC(=O)C1(CCCC1=O)CC(=O)O |
| InChIKey | JJTRRJRRBRCVSC-UHFFFAOYSA-N |
Product Overview
[1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid (CAS 7229-18-7), with molecular formula C10H14O5 and molecular weight 214.08 g/mol. IUPAC: 2-(1-ethoxycarbonyl-2-oxocyclopentyl)acetic acid.
Chemical Property Profile of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid
Property Insights of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid. Following Lipinski's Rule of Five, [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid has 1 hydrogen bond donor(s) and 5 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 [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid?
The CAS number of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid is 7229-18-7.
What is the molecular formula of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid?
The molecular formula of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid is C10H14O5.
What is the molecular weight of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid?
The molecular weight of [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid is 214.08 g/mol.
Where can I buy [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid?
You can request a quote for [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [1-(Ethoxycarbonyl)-2-oxocyclopentyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.