Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester
TL;DR: Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester (CAS 87048-88-2) is a chemical compound with molecular formula C16H20O7 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]acetate
Also Known As: 2,4-Bis(carbethoxymethoxy)acetophenone, ACETIC ACID, 2,2'-((4-ACETYL-1,3-PHENYLENE)BIS(OXY))BIS-, DIETHYL ESTER, 2,2'-((4-Acetyl-1,3-phenylene)bis(oxy))bisacetic acid diethyl ester, Diethyl 2,2'-[(4-acetyl-1,3-phenylene)bis(oxy)]diacetate, ethyl 2-[4-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]acetate
| Molecular Formula | C16H20O7 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 324.1209 |
| Heavy Atoms | 23 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 87048-88-2 |
|---|---|
| SMILES | CCOC(=O)COC1=CC(=C(C=C1)C(=O)C)OCC(=O)OCC |
| InChIKey | YLMAFCHDHZMCBE-UHFFFAOYSA-N |
Product Overview
Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester (CAS 87048-88-2), with molecular formula C16H20O7 and molecular weight 324.12 g/mol. IUPAC: ethyl 2-[4-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]acetate.
Chemical Property Profile of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester
Property Insights of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester. Following Lipinski's Rule of Five, Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester has 0 hydrogen bond donor(s) and 7 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 Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester?
The CAS number of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester is 87048-88-2.
What is the molecular formula of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester?
The molecular formula of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester is C16H20O7.
What is the molecular weight of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester?
The molecular weight of Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester is 324.12 g/mol.
Where can I buy Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester?
You can request a quote for Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2,2'-((4-acetyl-1,3-phenylene)bis(oxy))bis-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.