6-Bromo-1H-indole-2-carboxylic acid ethyl ester
TL;DR: 6-Bromo-1H-indole-2-carboxylic acid ethyl ester (CAS 372089-59-3) is a chemical compound with molecular formula C11H10BrNO2 and molecular weight 266.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-1H-indole-2-carboxylate
Also Known As: ETHYL 6-BROMOINDOLE-2-CARBOXYLATE, ethyl 6-bromo-1H-indole-2-carboxylate, 6-Br-ICA-OEt, 6-Bromo-2- carboethoxyindole, 6-Bromoindole-2-carboxylic acid ethyl ester
| Molecular Formula | C11H10BrNO2 |
|---|---|
| Molecular Weight | 266.99 g/mol |
| LogP | 3.1071 |
| Topological Polar Surface Area | 42.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.9895 |
| Heavy Atoms | 15 |
| Complexity | 504.25726 |
Chemical Identifiers
| CAS Number | 372089-59-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N1)C=C(C=C2)Br |
Product Overview
6-Bromo-1H-indole-2-carboxylic acid ethyl ester (CAS 372089-59-3), with molecular formula C11H10BrNO2 and molecular weight 266.99 g/mol. IUPAC: ethyl 6-bromo-1H-indole-2-carboxylate.
Chemical Property Profile of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester
Property Insights of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester
The XLogP value of 3.1071 indicates that 6-Bromo-1H-indole-2-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.09 Ų, 6-Bromo-1H-indole-2-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-1H-indole-2-carboxylic acid ethyl ester 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 6-Bromo-1H-indole-2-carboxylic acid ethyl ester?
The CAS number of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester is 372089-59-3.
What is the molecular formula of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester?
The molecular formula of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester is C11H10BrNO2.
What is the molecular weight of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester?
The molecular weight of 6-Bromo-1H-indole-2-carboxylic acid ethyl ester is 266.99 g/mol.
Where can I buy 6-Bromo-1H-indole-2-carboxylic acid ethyl ester?
You can request a quote for 6-Bromo-1H-indole-2-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-1H-indole-2-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-1H-indole-2-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.