4-(1,2,2-Trimethylcyclopentyl)benzoic acid
TL;DR: 4-(1,2,2-Trimethylcyclopentyl)benzoic acid (CAS 509-02-4) is a chemical compound with molecular formula C15H20O2 and molecular weight 232.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,2,2-trimethylcyclopentyl)benzoic acid
Also Known As: 4-(1,2,2-Trimethylcyclopentyl)benzoic acid
| Molecular Formula | C15H20O2 |
|---|---|
| Molecular Weight | 232.15 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.14633 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 509-02-4 |
|---|---|
| SMILES | CC1(CCCC1(C)C2=CC=C(C=C2)C(=O)O)C |
| InChIKey | NZAJKPWIGPUDBG-UHFFFAOYSA-N |
Product Overview
4-(1,2,2-Trimethylcyclopentyl)benzoic acid (CAS 509-02-4), with molecular formula C15H20O2 and molecular weight 232.15 g/mol. IUPAC: 4-(1,2,2-trimethylcyclopentyl)benzoic acid.
Chemical Property Profile of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid
Property Insights of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid
The XLogP value of 4.6 indicates that 4-(1,2,2-Trimethylcyclopentyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(1,2,2-Trimethylcyclopentyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,2,2-Trimethylcyclopentyl)benzoic 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 4-(1,2,2-Trimethylcyclopentyl)benzoic acid?
The CAS number of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid is 509-02-4.
What is the molecular formula of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid?
The molecular formula of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid is C15H20O2.
What is the molecular weight of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid?
The molecular weight of 4-(1,2,2-Trimethylcyclopentyl)benzoic acid is 232.15 g/mol.
Where can I buy 4-(1,2,2-Trimethylcyclopentyl)benzoic acid?
You can request a quote for 4-(1,2,2-Trimethylcyclopentyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,2,2-Trimethylcyclopentyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,2,2-Trimethylcyclopentyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.