2,3-Dihydro-indole-1-carboxylic acid ethyl ester
TL;DR: 2,3-Dihydro-indole-1-carboxylic acid ethyl ester (CAS 61589-17-1) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,3-dihydroindole-1-carboxylate
Also Known As: ethyl indolinecarboxylate, ChemDiv2_000979, ethyl 1-indolinecarboxylate, ethyl 2,3-dihydroindole-1-carboxylate, 2,3-Dihydro-indole-1-carboxylic acid ethyl ester
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 61589-17-1 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=CC=CC=C21 |
| InChIKey | FEFTZWVEDKFHFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dihydro-indole-1-carboxylic acid ethyl ester (CAS 61589-17-1), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: ethyl 2,3-dihydroindole-1-carboxylate.
Chemical Property Profile of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester
Property Insights of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydro-indole-1-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, 2,3-Dihydro-indole-1-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dihydro-indole-1-carboxylic acid ethyl ester has 0 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 2,3-Dihydro-indole-1-carboxylic acid ethyl ester?
The CAS number of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester is 61589-17-1.
What is the molecular formula of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester?
The molecular formula of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester is C11H13NO2.
What is the molecular weight of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester?
The molecular weight of 2,3-Dihydro-indole-1-carboxylic acid ethyl ester is 191.09 g/mol.
Where can I buy 2,3-Dihydro-indole-1-carboxylic acid ethyl ester?
You can request a quote for 2,3-Dihydro-indole-1-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 2,3-Dihydro-indole-1-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-indole-1-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.