methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate
TL;DR: methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate (CAS 142762-22-9) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate
Also Known As: Methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate, 3-Ethyl-4,5-dihydro-1H-indole-2-carboxylic acid methyl ester
Technical Specifications
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.11028 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 Da |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
| SMILES | CCC1=C(NC2=C1CCC=C2)C(=O)OC |
| InChIKey | YYWOYAFQDMXKOF-UHFFFAOYSA-N |
Chemical Property Profile of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate
Property Insights of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate. With a topological polar surface area (TPSA) of 42.1 Ų, methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate 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
What is the CAS number of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate?
The CAS number of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate is 142762-22-9.
What is the molecular formula of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate?
The molecular formula of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate is C12H15NO2.
What is the molecular weight of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate?
The molecular weight of methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate is 205.11028 g/mol.
Where can I buy methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate?
You can request a quote for methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for methyl 3-ethyl-4,5-dihydro-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.