Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate
TL;DR: Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate (CAS 219646-64-7) is a chemical compound with molecular formula C12H14O6 and molecular weight 254.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-hydroxy-3-methoxy-4-methylbenzene-1,2-dicarboxylate
Also Known As: dimethyl 5-hydroxy-3-methoxy-4-methylphthalate, dimethyl 5-hydroxy-3-methoxy-4-methylbenzene-1,2-dicarboxylate, Dimethyl 5-hydroxy-3-methoxy-4-methyl-benzene-1,2-dicarboxylate
| Molecular Formula | C12H14O6 |
|---|---|
| Molecular Weight | 254.08 g/mol |
| LogP | 1.28242 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.07904 |
| Heavy Atoms | 18 |
| Complexity | 491.83127 |
Chemical Identifiers
| CAS Number | 219646-64-7 |
|---|---|
| SMILES | CC1=C(C=C(C(=C1OC)C(=O)OC)C(=O)OC)O |
Product Overview
Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate (CAS 219646-64-7), with molecular formula C12H14O6 and molecular weight 254.08 g/mol. IUPAC: dimethyl 5-hydroxy-3-methoxy-4-methylbenzene-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate
Property Insights of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate
The XLogP value of 1.28242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate. Following Lipinski's Rule of Five, Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate has 1 hydrogen bond donor(s) and 6 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-hydroxy-3-methoxy-4-methylphthalate?
The CAS number of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate is 219646-64-7.
What is the molecular formula of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate?
The molecular formula of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate is C12H14O6.
What is the molecular weight of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate?
The molecular weight of Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate is 254.08 g/mol.
Where can I buy Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate?
You can request a quote for Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-hydroxy-3-methoxy-4-methylphthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.