安妥明
TL;DR: 安妥明 (CAS 637-07-0) is a chemical compound with molecular formula C12H15ClO3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
安妥明
ethyl 2-(4-chlorophenoxy)-2-methylpropanoate
Also Known As: clofibrate, Ethyl clofibrate, Clofibrato, Atromid, Liprin
| Molecular Formula | C12H15ClO3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.07097 |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
| Melting Point | 118-119 |
| Boiling Point | 149 |
| Density | 1.138-1.144 @ 20 °C |
| Solubility | Insoluble |
| Refractive Index | 1.500-1.505 @ 19.5-20.5 °C; MAX ABSORPTION (DEHYDRATED ETHANOL): 226 NM (A= 910, 1%, 1 CM); 280 NM (A= 87, 1%, 1 CM); 288 NM (A= 62, 1%, 1 CM) |
Chemical Identifiers
| CAS Number | 637-07-0 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl |
| InChIKey | KNHUKKLJHYUCFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
安妥明 (CAS 637-07-0), with molecular formula C12H15ClO3 and molecular weight 242.07 g/mol. IUPAC: ethyl 2-(4-chlorophenoxy)-2-methylpropanoate.
Chemical Property Profile of 安妥明
Property Insights of 安妥明
The XLogP value of 3.3 indicates that 安妥明 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 安妥明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 安妥明 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 安妥明?
The CAS number of 安妥明 is 637-07-0.
What is the molecular formula of 安妥明?
The molecular formula of 安妥明 is C12H15ClO3.
What is the molecular weight of 安妥明?
The molecular weight of 安妥明 is 242.07 g/mol.
Where can I buy 安妥明?
You can request a quote for 安妥明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 安妥明?
Yes, KEHONG BIO provides custom synthesis services for 安妥明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.