![Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate structure](/static/products/852/85212-85-7.png)
Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate
TL;DR: Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate (CAS 85212-85-7) is a chemical compound with molecular formula C13H14O7 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-formyl-3-(2-methoxy-2-oxoethoxy)phenoxy]acetate
Also Known As: methyl 2-[4-formyl-3-(2-methoxy-2-oxoethoxy)phenoxy]acetate, Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate, (4-Formyl-m-phenylendioxy)-di-essigsaeure-dimethylester, METHYL 2-[2-FORMYL-5-(METHOXYCARBONYLMETHOXY)PHENOXY]ACETATE
| Molecular Formula | C13H14O7 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 282.07394 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 85212-85-7 |
|---|---|
| SMILES | COC(=O)COC1=CC(=C(C=C1)C=O)OCC(=O)OC |
| InChIKey | IJZBVUYDAXAUDY-UHFFFAOYSA-N |
Product Overview
Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate (CAS 85212-85-7), with molecular formula C13H14O7 and molecular weight 282.07 g/mol. IUPAC: methyl 2-[4-formyl-3-(2-methoxy-2-oxoethoxy)phenoxy]acetate.
Chemical Property Profile of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate
Property Insights of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate. Following Lipinski's Rule of Five, Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate 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 Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate?
The CAS number of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate is 85212-85-7.
What is the molecular formula of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate?
The molecular formula of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate is C13H14O7.
What is the molecular weight of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate?
The molecular weight of Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate is 282.07 g/mol.
Where can I buy Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate?
You can request a quote for Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,2'-[(4-formyl-1,3-phenylene)bis(oxy)]diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.