1-(3-Fluorophenyl)cyclohexanecarboxylic acid
TL;DR: 1-(3-Fluorophenyl)cyclohexanecarboxylic acid (CAS 214262-98-3) is a chemical compound with molecular formula C13H15FO2 and molecular weight 222.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluorophenyl)cyclohexane-1-carboxylic acid
Also Known As: 1-(3-FLUOROPHENYL)CYCLOHEXANECARBOXYLIC ACID, 1-(3-fluorophenyl)cyclohexane-1-carboxylic Acid, 1- CYCLOHEXANECARBOXYLICACID,98, 1-(3-FLUOROPHENYL)CYCLOHEXANECARBOXYLICACID, 1-(3-FLUOROPHENYL)CYCLOHEXANECARBOXYLIC ACID, 98
| Molecular Formula | C13H15FO2 |
|---|---|
| Molecular Weight | 222.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.1056 |
| Heavy Atoms | 16 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 214262-98-3 |
|---|---|
| SMILES | C1CCC(CC1)(C2=CC(=CC=C2)F)C(=O)O |
| InChIKey | RIQOIHJORXEGFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Fluorophenyl)cyclohexanecarboxylic acid (CAS 214262-98-3), with molecular formula C13H15FO2 and molecular weight 222.11 g/mol. IUPAC: 1-(3-fluorophenyl)cyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid
Property Insights of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid
The XLogP value of 3.5 indicates that 1-(3-Fluorophenyl)cyclohexanecarboxylic 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-(3-Fluorophenyl)cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Fluorophenyl)cyclohexanecarboxylic 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 1-(3-Fluorophenyl)cyclohexanecarboxylic acid?
The CAS number of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid is 214262-98-3.
What is the molecular formula of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid?
The molecular formula of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid is C13H15FO2.
What is the molecular weight of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid?
The molecular weight of 1-(3-Fluorophenyl)cyclohexanecarboxylic acid is 222.11 g/mol.
Where can I buy 1-(3-Fluorophenyl)cyclohexanecarboxylic acid?
You can request a quote for 1-(3-Fluorophenyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Fluorophenyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Fluorophenyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.