RefChem:316377
TL;DR: RefChem:316377 (CAS 112489-28-8) is a chemical compound with molecular formula C27H32O11 and molecular weight 532.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-acetyl-3-[3-[2-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]-2-hydroxypropoxy]phenoxy]acetate
Also Known As: 1,3-Bis(2-acetyl-3-carbethoxymethoxyphenoxy)-2-propanol, Acetic acid, 2,2'-(2-hydroxytrimethylenebis(oxy(2-acetyl-m-phenylene)oxy))di-, diethyl ester, 2,2'-(2-Hydroxytrimethylenebis(oxy(2-acetyl-m-phenylene)oxy))diacetic acid diethyl ester, Diethyl 2,2'-{(2-hydroxypropane-1,3-diyl)bis[oxy(2-acetyl-3,1-phenylene)oxy]}diacetate, ethyl 2-[2-acetyl-3-[3-[2-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]-2-hydroxypropoxy]phenoxy]acetate
| Molecular Formula | C27H32O11 |
|---|---|
| Molecular Weight | 532.19 g/mol |
| LogP | 2.7943 |
| Topological Polar Surface Area | 143.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 532.19446 |
| Heavy Atoms | 38 |
| Complexity | 1038.5021 |
Chemical Identifiers
| CAS Number | 112489-28-8 |
|---|---|
| SMILES | CCOC(=O)COC1=CC=CC(=C1C(=O)C)OCC(COC2=C(C(=CC=C2)OCC(=O)OCC)C(=O)C)O |
Product Overview
RefChem:316377 (CAS 112489-28-8), with molecular formula C27H32O11 and molecular weight 532.19 g/mol. IUPAC: ethyl 2-[2-acetyl-3-[3-[2-acetyl-3-(2-ethoxy-2-oxoethoxy)phenoxy]-2-hydroxypropoxy]phenoxy]acetate.
Chemical Property Profile of RefChem:316377
Property Insights of RefChem:316377
The XLogP value of 2.7943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:316377. The TPSA of 143.89 Ų indicates high polarity, suggesting RefChem:316377 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:316377 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:316377?
The CAS number of RefChem:316377 is 112489-28-8.
What is the molecular formula of RefChem:316377?
The molecular formula of RefChem:316377 is C27H32O11.
What is the molecular weight of RefChem:316377?
The molecular weight of RefChem:316377 is 532.19 g/mol.
Where can I buy RefChem:316377?
You can request a quote for RefChem:316377 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316377?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316377 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.