2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid
TL;DR: 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid (CAS 15235-82-2) 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.
2,3,5-trimethyl-4-oxocyclopentane-1-carboxylic acid
Also Known As: 2,3,5-trimethyl-4-oxocyclopentane-1-carboxylic acid, Cyclopentanecarboxylic acid, 2,3,5-trimethyl-4-oxo-
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 15235-82-2 |
|---|---|
| SMILES | CC1C(C(=O)C(C1C(=O)O)C)C |
| InChIKey | AZNKKGKPXLDLBE-UHFFFAOYSA-N |
Product Overview
2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid (CAS 15235-82-2), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: 2,3,5-trimethyl-4-oxocyclopentane-1-carboxylic acid.
Chemical Property Profile of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid
Property Insights of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid. With a topological polar surface area (TPSA) of 54.4 Ų, 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic 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 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid?
The CAS number of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid is 15235-82-2.
What is the molecular formula of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid?
The molecular formula of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid is C9H14O3.
What is the molecular weight of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid?
The molecular weight of 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid is 170.09 g/mol.
Where can I buy 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid?
You can request a quote for 2,3,5-Trimethyl-4-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 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5-Trimethyl-4-oxocyclopentane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.