Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester
TL;DR: Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester (CAS 110554-10-4) is a chemical compound with molecular formula C19H22O7 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2-bis(3,4-dimethoxyphenyl)-2-hydroxyacetate
Also Known As: Methyl bis(3,4-dimethoxyphenyl)(hydroxy)acetate, Methyl bis(3,4-dimethoxyphenyl)(hydroxy)acetate #, methyl 2,2-bis(3,4-dimethoxyphenyl)-2-hydroxyacetate, Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester
| Molecular Formula | C19H22O7 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.13657 |
| Heavy Atoms | 26 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 110554-10-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)OC)OC)(C(=O)OC)O)OC |
| InChIKey | KXCZCWAQTLDDCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester (CAS 110554-10-4), with molecular formula C19H22O7 and molecular weight 362.14 g/mol. IUPAC: methyl 2,2-bis(3,4-dimethoxyphenyl)-2-hydroxyacetate.
Chemical Property Profile of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester
Property Insights of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester. Following Lipinski's Rule of Five, Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester has 1 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 Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester?
The CAS number of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester is 110554-10-4.
What is the molecular formula of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester?
The molecular formula of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester is C19H22O7.
What is the molecular weight of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester?
The molecular weight of Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester is 362.14 g/mol.
Where can I buy Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester?
You can request a quote for Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Bis-(3,4-dimethoxyphenyl)-hydroxyacetic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.