2-Methyl-1H-indole-3-carboxylic acid
TL;DR: 2-Methyl-1H-indole-3-carboxylic acid (CAS 422-62-8) is a chemical compound with molecular formula C10H9NO2 and molecular weight 175.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1H-indole-3-carboxylic acid
Also Known As: 2-Methyl-1H-indole-3-carboxylic acid, pentafluoropropylamidine, 2-methylindole-3-carboxylic acid, 2-Methylindol-3-carbonsaure, 1H-Indole-3-carboxylic acid, 2-methyl-
| Molecular Formula | C10H9NO2 |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 2.17452 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.06332 |
| Heavy Atoms | 13 |
| Complexity | 470.72952 |
Chemical Identifiers
| CAS Number | 422-62-8 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C(=O)O |
Product Overview
2-Methyl-1H-indole-3-carboxylic acid (CAS 422-62-8), with molecular formula C10H9NO2 and molecular weight 175.06 g/mol. IUPAC: 2-methyl-1H-indole-3-carboxylic acid.
Chemical Property Profile of 2-Methyl-1H-indole-3-carboxylic acid
Property Insights of 2-Methyl-1H-indole-3-carboxylic acid
The XLogP value of 2.17452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1H-indole-3-carboxylic acid. With a topological polar surface area (TPSA) of 53.09 Ų, 2-Methyl-1H-indole-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1H-indole-3-carboxylic acid has 2 hydrogen bond donor(s) and 1 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 2-Methyl-1H-indole-3-carboxylic acid?
The CAS number of 2-Methyl-1H-indole-3-carboxylic acid is 422-62-8.
What is the molecular formula of 2-Methyl-1H-indole-3-carboxylic acid?
The molecular formula of 2-Methyl-1H-indole-3-carboxylic acid is C10H9NO2.
What is the molecular weight of 2-Methyl-1H-indole-3-carboxylic acid?
The molecular weight of 2-Methyl-1H-indole-3-carboxylic acid is 175.06 g/mol.
Where can I buy 2-Methyl-1H-indole-3-carboxylic acid?
You can request a quote for 2-Methyl-1H-indole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1H-indole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1H-indole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.