1-Ethyl-2-methyl-1H-indole-3-carbaldehyde
TL;DR: 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde (CAS 66727-64-8) is a chemical compound with molecular formula C12H13NO and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-methylindole-3-carbaldehyde
Also Known As: 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde, 1-ethyl-2-methylindole-3-carbaldehyde, ASISCHEM W99822, 1-Ethyl-2-Methyl-1H-indole-3-carboxaldehyde, BAS 07571502
| Molecular Formula | C12H13NO |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 2.78212 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.09972 |
| Heavy Atoms | 14 |
| Complexity | 482.27255 |
Chemical Identifiers
| CAS Number | 66727-64-8 |
|---|---|
| SMILES | CCN1C(=C(C2=CC=CC=C21)C=O)C |
Product Overview
1-Ethyl-2-methyl-1H-indole-3-carbaldehyde (CAS 66727-64-8), with molecular formula C12H13NO and molecular weight 187.10 g/mol. IUPAC: 1-ethyl-2-methylindole-3-carbaldehyde.
Chemical Property Profile of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde
Property Insights of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde
The XLogP value of 2.78212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde. With a topological polar surface area (TPSA) of 22.0 Ų, 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde has 0 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-2-methyl-1H-indole-3-carbaldehyde?
The CAS number of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde is 66727-64-8.
What is the molecular formula of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde?
The molecular formula of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde is C12H13NO.
What is the molecular weight of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde?
The molecular weight of 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde is 187.10 g/mol.
Where can I buy 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde?
You can request a quote for 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-2-methyl-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.