1-ethyl-1H-indole-3-carboxylic acid
TL;DR: 1-ethyl-1H-indole-3-carboxylic acid (CAS 132797-91-2) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylindole-3-carboxylic acid
Also Known As: 1-ethyl-1H-indole-3-carboxylic acid, 1-ethylindole-3-carboxylic acid, Bionet2_001301, 1H-Indole-3-carboxylic acid, 1-ethyl-, 1-ethyl 1h-indole-3-carboxylic acid
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 2.3594 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 484.99323 |
Chemical Identifiers
| CAS Number | 132797-91-2 |
|---|---|
| SMILES | CCN1C=C(C2=CC=CC=C21)C(=O)O |
Product Overview
1-ethyl-1H-indole-3-carboxylic acid (CAS 132797-91-2), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 1-ethylindole-3-carboxylic acid.
Chemical Property Profile of 1-ethyl-1H-indole-3-carboxylic acid
Property Insights of 1-ethyl-1H-indole-3-carboxylic acid
The XLogP value of 2.3594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-ethyl-1H-indole-3-carboxylic acid. With a topological polar surface area (TPSA) of 42.23 Ų, 1-ethyl-1H-indole-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-ethyl-1H-indole-3-carboxylic acid has 1 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 1-ethyl-1H-indole-3-carboxylic acid?
The CAS number of 1-ethyl-1H-indole-3-carboxylic acid is 132797-91-2.
What is the molecular formula of 1-ethyl-1H-indole-3-carboxylic acid?
The molecular formula of 1-ethyl-1H-indole-3-carboxylic acid is C11H11NO2.
What is the molecular weight of 1-ethyl-1H-indole-3-carboxylic acid?
The molecular weight of 1-ethyl-1H-indole-3-carboxylic acid is 189.08 g/mol.
Where can I buy 1-ethyl-1H-indole-3-carboxylic acid?
You can request a quote for 1-ethyl-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 1-ethyl-1H-indole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-ethyl-1H-indole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.