Methyl 2-formyl-6-hydroxybenzoate
TL;DR: Methyl 2-formyl-6-hydroxybenzoate (CAS 136192-84-2) is a chemical compound with molecular formula C9H8O4 and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-formyl-6-hydroxybenzoate
Also Known As: methyl 2-formyl-6-hydroxybenzoate, methyl2-formyl-6-hydroxybenzoate, Methyl 2-hydroxy-6-formylbenzoate, methyl 2-formyl-6-hydroxy-benzoate, 2-Formyl-6-hydroxybenzoic acid methyl ester
| Molecular Formula | C9H8O4 |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.04225 |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 136192-84-2 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC=C1O)C=O |
| InChIKey | WDYYLHVXCSRDRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-formyl-6-hydroxybenzoate (CAS 136192-84-2), with molecular formula C9H8O4 and molecular weight 180.04 g/mol. IUPAC: methyl 2-formyl-6-hydroxybenzoate.
Chemical Property Profile of Methyl 2-formyl-6-hydroxybenzoate
Property Insights of Methyl 2-formyl-6-hydroxybenzoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-formyl-6-hydroxybenzoate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-formyl-6-hydroxybenzoate. Following Lipinski's Rule of Five, Methyl 2-formyl-6-hydroxybenzoate has 1 hydrogen bond donor(s) and 4 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-formyl-6-hydroxybenzoate?
The CAS number of Methyl 2-formyl-6-hydroxybenzoate is 136192-84-2.
What is the molecular formula of Methyl 2-formyl-6-hydroxybenzoate?
The molecular formula of Methyl 2-formyl-6-hydroxybenzoate is C9H8O4.
What is the molecular weight of Methyl 2-formyl-6-hydroxybenzoate?
The molecular weight of Methyl 2-formyl-6-hydroxybenzoate is 180.04 g/mol.
Where can I buy Methyl 2-formyl-6-hydroxybenzoate?
You can request a quote for Methyl 2-formyl-6-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-formyl-6-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-formyl-6-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.