Methyl 2,3,4-trihydroxybenzoate
TL;DR: Methyl 2,3,4-trihydroxybenzoate (CAS 56128-66-6) is a chemical compound with molecular formula C8H8O5 and molecular weight 184.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,3,4-trihydroxybenzoate
Also Known As: methyl 2,3,4-trihydroxybenzoate, methyl2,3,4-trihydroxybenzoate, methyl-2,3,4-trihydroxybenzoate, Me ester-2,3,4-Trihydroxybenzoic acid, 2,3,4-Trihydroxybenzoic acid methyl ester
| Molecular Formula | C8H8O5 |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | 0.59 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.03717 |
| Heavy Atoms | 13 |
| Complexity | 344.63278 |
Chemical Identifiers
| CAS Number | 56128-66-6 |
|---|---|
| SMILES | COC(=O)C1=C(C(=C(C=C1)O)O)O |
Product Overview
Methyl 2,3,4-trihydroxybenzoate (CAS 56128-66-6), with molecular formula C8H8O5 and molecular weight 184.04 g/mol. IUPAC: methyl 2,3,4-trihydroxybenzoate.
Chemical Property Profile of Methyl 2,3,4-trihydroxybenzoate
Property Insights of Methyl 2,3,4-trihydroxybenzoate
The XLogP value of 0.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,3,4-trihydroxybenzoate. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,3,4-trihydroxybenzoate. Following Lipinski's Rule of Five, Methyl 2,3,4-trihydroxybenzoate has 3 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 Methyl 2,3,4-trihydroxybenzoate?
The CAS number of Methyl 2,3,4-trihydroxybenzoate is 56128-66-6.
What is the molecular formula of Methyl 2,3,4-trihydroxybenzoate?
The molecular formula of Methyl 2,3,4-trihydroxybenzoate is C8H8O5.
What is the molecular weight of Methyl 2,3,4-trihydroxybenzoate?
The molecular weight of Methyl 2,3,4-trihydroxybenzoate is 184.04 g/mol.
Where can I buy Methyl 2,3,4-trihydroxybenzoate?
You can request a quote for Methyl 2,3,4-trihydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3,4-trihydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3,4-trihydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.