1-(4-Methylphenyl)cyclopentanecarboxylic acid
TL;DR: 1-(4-Methylphenyl)cyclopentanecarboxylic acid (CAS 80789-75-9) is a chemical compound with molecular formula C13H16O2 and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)cyclopentane-1-carboxylic acid
Also Known As: 1-(4-Methylphenyl)cyclopentanecarboxylic acid, 1-(p-Tolyl)cyclopentanecarboxylic acid, pyridoxamine-5-phosphate, 1-(4-methylphenyl)cyclopentane-1-carboxylic acid, 1-(P-Tolyl)-1-Cyclopentanecarboxylic Acid
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.11504 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 80789-75-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(CCCC2)C(=O)O |
| InChIKey | YKDWTRWSHHGVII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Methylphenyl)cyclopentanecarboxylic acid (CAS 80789-75-9), with molecular formula C13H16O2 and molecular weight 204.12 g/mol. IUPAC: 1-(4-methylphenyl)cyclopentane-1-carboxylic acid.
Chemical Property Profile of 1-(4-Methylphenyl)cyclopentanecarboxylic acid
Property Insights of 1-(4-Methylphenyl)cyclopentanecarboxylic acid
The XLogP value of 3.2 indicates that 1-(4-Methylphenyl)cyclopentanecarboxylic 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, 1-(4-Methylphenyl)cyclopentanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)cyclopentanecarboxylic 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 1-(4-Methylphenyl)cyclopentanecarboxylic acid?
The CAS number of 1-(4-Methylphenyl)cyclopentanecarboxylic acid is 80789-75-9.
What is the molecular formula of 1-(4-Methylphenyl)cyclopentanecarboxylic acid?
The molecular formula of 1-(4-Methylphenyl)cyclopentanecarboxylic acid is C13H16O2.
What is the molecular weight of 1-(4-Methylphenyl)cyclopentanecarboxylic acid?
The molecular weight of 1-(4-Methylphenyl)cyclopentanecarboxylic acid is 204.12 g/mol.
Where can I buy 1-(4-Methylphenyl)cyclopentanecarboxylic acid?
You can request a quote for 1-(4-Methylphenyl)cyclopentanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)cyclopentanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)cyclopentanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.