Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester
TL;DR: Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester (CAS 68003-53-2) is a chemical compound with molecular formula C14H24O3 and molecular weight 240.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-heptyl-2-oxocyclopentane-1-carboxylate
Also Known As: 2-Heptyl-2-carbomethoxycyclopentanone, Methyl 1-heptyl-2-oxocyclopentanecarboxylate, methyl1-heptyl-2-oxocyclopentanecarboxylate, methyl 1-heptyl-2-oxocyclopentane-1-carboxylate, Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester
| Molecular Formula | C14H24O3 |
|---|---|
| Molecular Weight | 240.17 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 240.17255 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 68003-53-2 |
|---|---|
| SMILES | CCCCCCCC1(CCCC1=O)C(=O)OC |
| InChIKey | NUKUEPMJQQXHDS-UHFFFAOYSA-N |
Product Overview
Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester (CAS 68003-53-2), with molecular formula C14H24O3 and molecular weight 240.17 g/mol. IUPAC: methyl 1-heptyl-2-oxocyclopentane-1-carboxylate.
Chemical Property Profile of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester
Property Insights of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester
The XLogP value of 3.9 indicates that Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester 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 Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester?
The CAS number of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester is 68003-53-2.
What is the molecular formula of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester?
The molecular formula of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester is C14H24O3.
What is the molecular weight of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester?
The molecular weight of Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester is 240.17 g/mol.
Where can I buy Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester?
You can request a quote for Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanecarboxylic acid, 1-heptyl-2-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.