Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
TL;DR: Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate (CAS 58917-85-4) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
Also Known As: ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate, J1.868.748H, ethyl 3-hydroxy-2-methyl-3,3-diphenylpropionate, 2-Methyl-3-hydroxy-3,3-diphenylpropanoic acid ethyl ester
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 58917-85-4 |
|---|---|
| SMILES | CCOC(=O)C(C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
| InChIKey | NDMGXGFCUBFVEN-UHFFFAOYSA-N |
Product Overview
Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate (CAS 58917-85-4), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate.
Chemical Property Profile of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
Property Insights of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
The XLogP value of 3.3 indicates that Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate 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 Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The CAS number of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is 58917-85-4.
What is the molecular formula of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The molecular formula of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is C18H20O3.
What is the molecular weight of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The molecular weight of Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is 284.14 g/mol.
Where can I buy Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
You can request a quote for Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.