Dimethyl-5-methoxyisophthalate
TL;DR: Dimethyl-5-methoxyisophthalate (CAS 20319-44-2) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-methoxybenzene-1,3-dicarboxylate
Also Known As: Dimethyl 5-methoxyisophthalate, Dimethyl 5-methoxybenzene-1,3-dicarboxylate, 5-Methoxy-isophthalic acid dimethyl ester, dimethyl-5-methoxyisophthalate, Dimethyl5-Methoxyisophthalate
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 1.2684 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 376.586 |
Chemical Identifiers
| CAS Number | 20319-44-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C(=O)OC)C(=O)OC |
Product Overview
Dimethyl-5-methoxyisophthalate (CAS 20319-44-2), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: dimethyl 5-methoxybenzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl-5-methoxyisophthalate
Property Insights of Dimethyl-5-methoxyisophthalate
The XLogP value of 1.2684 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl-5-methoxyisophthalate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl-5-methoxyisophthalate. Following Lipinski's Rule of Five, Dimethyl-5-methoxyisophthalate has 0 hydrogen bond donor(s) and 5 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-5-methoxyisophthalate?
The CAS number of Dimethyl-5-methoxyisophthalate is 20319-44-2.
What is the molecular formula of Dimethyl-5-methoxyisophthalate?
The molecular formula of Dimethyl-5-methoxyisophthalate is C11H12O5.
What is the molecular weight of Dimethyl-5-methoxyisophthalate?
The molecular weight of Dimethyl-5-methoxyisophthalate is 224.07 g/mol.
Where can I buy Dimethyl-5-methoxyisophthalate?
You can request a quote for Dimethyl-5-methoxyisophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl-5-methoxyisophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl-5-methoxyisophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.