Dimethyl 3-methoxyphthalate
TL;DR: Dimethyl 3-methoxyphthalate (CAS 32136-52-0) 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 3-methoxybenzene-1,2-dicarboxylate
Also Known As: dimethyl 3-methoxyphthalate, dimethyl 3-methoxybenzene-1,2-dicarboxylate, 3-Methoxyphthalic acid dimethyl ester, methoxybenzenedicarboxylic acid dimethyl ester, 1,2-Benzenedicarboxylicacid, 3-methoxy-, 1,2-dimethyl ester
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 32136-52-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1C(=O)OC)C(=O)OC |
| InChIKey | KKSNRHOMXHCRGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl 3-methoxyphthalate (CAS 32136-52-0), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: dimethyl 3-methoxybenzene-1,2-dicarboxylate.
Chemical Property Profile of Dimethyl 3-methoxyphthalate
Property Insights of Dimethyl 3-methoxyphthalate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3-methoxyphthalate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3-methoxyphthalate. Following Lipinski's Rule of Five, Dimethyl 3-methoxyphthalate 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 3-methoxyphthalate?
The CAS number of Dimethyl 3-methoxyphthalate is 32136-52-0.
What is the molecular formula of Dimethyl 3-methoxyphthalate?
The molecular formula of Dimethyl 3-methoxyphthalate is C11H12O5.
What is the molecular weight of Dimethyl 3-methoxyphthalate?
The molecular weight of Dimethyl 3-methoxyphthalate is 224.07 g/mol.
Where can I buy Dimethyl 3-methoxyphthalate?
You can request a quote for Dimethyl 3-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-methoxyphthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3-methoxyphthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.