1-(4-氯苯基)环己烷甲酸
TL;DR: 1-(4-氯苯基)环己烷甲酸 (CAS 58880-37-8) is a chemical compound with molecular formula C13H15ClO2 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-氯苯基)环己烷甲酸
1-(4-chlorophenyl)cyclohexane-1-carboxylic acid
Also Known As: 1-(4-Chlorophenyl)cyclohexanecarboxylic acid, 1-(4-Chlorophenyl)cyclohexane-1-carboxylic acid, 1-(4-Chlorophenyl)-1-Cyclohexanecarboxylic Acid, 1-(4-Chlorophenyl)-1-cyclohexane-carboxylic acid, 4-chlorophenylcyclohexanecarboxylic acid
| Molecular Formula | C13H15ClO2 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.07605 |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 58880-37-8 |
|---|---|
| SMILES | C1CCC(CC1)(C2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | UPNXUJXIIZGXLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-氯苯基)环己烷甲酸 (CAS 58880-37-8), with molecular formula C13H15ClO2 and molecular weight 238.08 g/mol. IUPAC: 1-(4-chlorophenyl)cyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-(4-氯苯基)环己烷甲酸
Property Insights of 1-(4-氯苯基)环己烷甲酸
The XLogP value of 4.0 indicates that 1-(4-氯苯基)环己烷甲酸 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-氯苯基)环己烷甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-氯苯基)环己烷甲酸 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-氯苯基)环己烷甲酸?
The CAS number of 1-(4-氯苯基)环己烷甲酸 is 58880-37-8.
What is the molecular formula of 1-(4-氯苯基)环己烷甲酸?
The molecular formula of 1-(4-氯苯基)环己烷甲酸 is C13H15ClO2.
What is the molecular weight of 1-(4-氯苯基)环己烷甲酸?
The molecular weight of 1-(4-氯苯基)环己烷甲酸 is 238.08 g/mol.
Where can I buy 1-(4-氯苯基)环己烷甲酸?
You can request a quote for 1-(4-氯苯基)环己烷甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-氯苯基)环己烷甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-氯苯基)环己烷甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.