1H-indole-6-carboxylic acid
TL;DR: 1H-indole-6-carboxylic acid (CAS 1160294-26-7) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.04768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1H-indole-6-carboxylic acid
Also Known As: Indole-6-carboxylic acid, 1H-Indole-6-carboxylic acid, 6-carboxyindole, null, Vargatef
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H7NO2 |
| Molecular Weight | 161.04768 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.04768 Da |
| Heavy Atoms | 12 |
| Complexity | 193.0 |
| SMILES | C1=CC(=CC2=C1C=CN2)C(=O)O |
| InChIKey | GHTDODSYDCPOCW-UHFFFAOYSA-N |
Chemical Property Profile of 1H-indole-6-carboxylic acid
Property Insights of 1H-indole-6-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-indole-6-carboxylic acid. With a topological polar surface area (TPSA) of 53.1 Ų, 1H-indole-6-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-indole-6-carboxylic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-indole-6-carboxylic acid?
The CAS number of 1H-indole-6-carboxylic acid is 1160294-26-7.
What is the molecular formula of 1H-indole-6-carboxylic acid?
The molecular formula of 1H-indole-6-carboxylic acid is C9H7NO2.
What is the molecular weight of 1H-indole-6-carboxylic acid?
The molecular weight of 1H-indole-6-carboxylic acid is 161.04768 g/mol.
Where can I buy 1H-indole-6-carboxylic acid?
You can request a quote for 1H-indole-6-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-indole-6-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1H-indole-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.