Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate
TL;DR: Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate (CAS 94159-22-5) is a chemical compound with molecular formula C16H21ClO3 and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 2-(4-chloro-2-methylphenoxy)propanoate
Also Known As: cyclohexyl2- propionate, EINECS 303-199-5, Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate, cyclohexyl 2-(4-chloro-2-methylphenoxy)propanoate, 2-(4-Chloro-2-methylphenoxy)propionic acid cyclohexyl ester
| Molecular Formula | C16H21ClO3 |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 4.29162 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.11792 |
| Heavy Atoms | 20 |
| Complexity | 466.78983 |
Chemical Identifiers
| CAS Number | 94159-22-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OC(C)C(=O)OC2CCCCC2 |
Product Overview
Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate (CAS 94159-22-5), with molecular formula C16H21ClO3 and molecular weight 296.12 g/mol. IUPAC: cyclohexyl 2-(4-chloro-2-methylphenoxy)propanoate.
Chemical Property Profile of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate
Property Insights of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate
The XLogP value of 4.29162 indicates that Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate has 0 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 Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate?
The CAS number of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate is 94159-22-5.
What is the molecular formula of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate?
The molecular formula of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate is C16H21ClO3.
What is the molecular weight of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate?
The molecular weight of Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate is 296.12 g/mol.
Where can I buy Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate?
You can request a quote for Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl 2-(4-chloro-2-methylphenoxy)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.