3-formyl-1-methyl-1H-indole-2-carboxylic acid
TL;DR: 3-formyl-1-methyl-1H-indole-2-carboxylic acid (CAS 174094-26-9) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-formyl-1-methylindole-2-carboxylic acid
Also Known As: 3-formyl-1-methyl-1H-indole-2-carboxylic acid, 3-formyl-1-methylindole-2-carboxylic acid, 3-formyl-1-methyl-indole-2-carboxylic Acid, 3-formyl-1-methyl-1H-indole-2-carboxylicacid, 891-524-6
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 1.689 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 554.20355 |
Chemical Identifiers
| CAS Number | 174094-26-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C1C(=O)O)C=O |
Product Overview
3-formyl-1-methyl-1H-indole-2-carboxylic acid (CAS 174094-26-9), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: 3-formyl-1-methylindole-2-carboxylic acid.
Chemical Property Profile of 3-formyl-1-methyl-1H-indole-2-carboxylic acid
Property Insights of 3-formyl-1-methyl-1H-indole-2-carboxylic acid
The XLogP value of 1.689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-formyl-1-methyl-1H-indole-2-carboxylic acid. With a topological polar surface area (TPSA) of 59.3 Ų, 3-formyl-1-methyl-1H-indole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-formyl-1-methyl-1H-indole-2-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 3-formyl-1-methyl-1H-indole-2-carboxylic acid?
The CAS number of 3-formyl-1-methyl-1H-indole-2-carboxylic acid is 174094-26-9.
What is the molecular formula of 3-formyl-1-methyl-1H-indole-2-carboxylic acid?
The molecular formula of 3-formyl-1-methyl-1H-indole-2-carboxylic acid is C11H9NO3.
What is the molecular weight of 3-formyl-1-methyl-1H-indole-2-carboxylic acid?
The molecular weight of 3-formyl-1-methyl-1H-indole-2-carboxylic acid is 203.06 g/mol.
Where can I buy 3-formyl-1-methyl-1H-indole-2-carboxylic acid?
You can request a quote for 3-formyl-1-methyl-1H-indole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-formyl-1-methyl-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-formyl-1-methyl-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.