Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester
TL;DR: Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester (CAS 62059-59-0) 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.
methyl 6-formyl-2,3-dimethoxybenzoate
Also Known As: methyl 6-formyl-2,3-dimethoxybenzoate, Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester, methyl 6-formyl-2,3-dimethoxy-benzoate, 2-(Methoxycarbonyl)-3,4-dimethoxybenzaldehyde, J2.087.545C
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 1.3029 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 411.08112 |
Chemical Identifiers
| CAS Number | 62059-59-0 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C=O)C(=O)OC)OC |
Product Overview
Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester (CAS 62059-59-0), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: methyl 6-formyl-2,3-dimethoxybenzoate.
Chemical Property Profile of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester
Property Insights of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester
The XLogP value of 1.3029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester. Following Lipinski's Rule of Five, Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester 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 Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester?
The CAS number of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester is 62059-59-0.
What is the molecular formula of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester?
The molecular formula of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester is C11H12O5.
What is the molecular weight of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester?
The molecular weight of Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester is 224.07 g/mol.
Where can I buy Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester?
You can request a quote for Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 6-formyl-2,3-dimethoxy-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.