cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid
TL;DR: cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid (CAS 37172-52-4) is a chemical compound with molecular formula C12H20O3 and molecular weight 212.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid
Also Known As: Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, Cyclopentanecarboxylic acid,2-hexyl-3-oxo, (1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid
| Molecular Formula | C12H20O3 |
|---|---|
| Molecular Weight | 212.14 g/mol |
| LogP | 2.6367 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.14125 |
| Heavy Atoms | 15 |
| Complexity | 235.02173 |
Chemical Identifiers
| CAS Number | 37172-52-4 |
|---|---|
| SMILES | CCCCCC[C@H]1[C@@H](CCC1=O)C(=O)O |
Product Overview
cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid (CAS 37172-52-4), with molecular formula C12H20O3 and molecular weight 212.14 g/mol. IUPAC: cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid.
Chemical Property Profile of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid
Property Insights of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid
The XLogP value of 2.6367 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid. With a topological polar surface area (TPSA) of 54.37 Ų, cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid?
The CAS number of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid is 37172-52-4.
What is the molecular formula of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid?
The molecular formula of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid is C12H20O3.
What is the molecular weight of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid?
The molecular weight of cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid is 212.14 g/mol.
Where can I buy cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid?
You can request a quote for cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for cis-(1R,2S)-2-hexyl-3-oxocyclopentane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.