Dimethyl 3,6-dihydroxy-4-methoxyphthalate
TL;DR: Dimethyl 3,6-dihydroxy-4-methoxyphthalate (CAS 103548-65-8) is a chemical compound with molecular formula C11H12O7 and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3,6-dihydroxy-4-methoxybenzene-1,2-dicarboxylate
Also Known As: dimethyl 3,6-dihydroxy-4-methoxyphthalate, J2.348.690C, 3,6-Dihydroxy-4-methoxyphthalic acid dimethyl ester, dimethyl 3,6-dihydroxy-4-methoxybenzene-1,2-dicarboxylate, 1,2-dimethyl 3,6-dihydroxy-4-methoxybenzene-1,2-dicarboxylate
| Molecular Formula | C11H12O7 |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.0583 |
| Heavy Atoms | 18 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 103548-65-8 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)O)C(=O)OC)C(=O)OC)O |
| InChIKey | HMDYIGYECQQICB-UHFFFAOYSA-N |
Product Overview
Dimethyl 3,6-dihydroxy-4-methoxyphthalate (CAS 103548-65-8), with molecular formula C11H12O7 and molecular weight 256.06 g/mol. IUPAC: dimethyl 3,6-dihydroxy-4-methoxybenzene-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 3,6-dihydroxy-4-methoxyphthalate
Property Insights of Dimethyl 3,6-dihydroxy-4-methoxyphthalate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3,6-dihydroxy-4-methoxyphthalate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3,6-dihydroxy-4-methoxyphthalate. Following Lipinski's Rule of Five, Dimethyl 3,6-dihydroxy-4-methoxyphthalate has 2 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 3,6-dihydroxy-4-methoxyphthalate?
The CAS number of Dimethyl 3,6-dihydroxy-4-methoxyphthalate is 103548-65-8.
What is the molecular formula of Dimethyl 3,6-dihydroxy-4-methoxyphthalate?
The molecular formula of Dimethyl 3,6-dihydroxy-4-methoxyphthalate is C11H12O7.
What is the molecular weight of Dimethyl 3,6-dihydroxy-4-methoxyphthalate?
The molecular weight of Dimethyl 3,6-dihydroxy-4-methoxyphthalate is 256.06 g/mol.
Where can I buy Dimethyl 3,6-dihydroxy-4-methoxyphthalate?
You can request a quote for Dimethyl 3,6-dihydroxy-4-methoxyphthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3,6-dihydroxy-4-methoxyphthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3,6-dihydroxy-4-methoxyphthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.