3-Formyl-2-methylindole
TL;DR: 3-Formyl-2-methylindole (CAS 5416-80-8) is a chemical compound with molecular formula C10H9NO and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1H-indole-3-carbaldehyde
Also Known As: 2-Methyl-1H-indole-3-carbaldehyde, 2-Methylindole-3-carboxaldehyde, 3-Formyl-2-methylindole, 2-Methyl-3-formylindole, 1H-Indole-3-carboxaldehyde, 2-methyl-
| Molecular Formula | C10H9NO |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.06842 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 5416-80-8 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C=O |
| InChIKey | CYZIVXOEJNAIBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Formyl-2-methylindole (CAS 5416-80-8), with molecular formula C10H9NO and molecular weight 159.07 g/mol. IUPAC: 2-methyl-1H-indole-3-carbaldehyde.
Chemical Property Profile of 3-Formyl-2-methylindole
Property Insights of 3-Formyl-2-methylindole
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Formyl-2-methylindole. With a topological polar surface area (TPSA) of 32.9 Ų, 3-Formyl-2-methylindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Formyl-2-methylindole 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 3-Formyl-2-methylindole?
The CAS number of 3-Formyl-2-methylindole is 5416-80-8.
What is the molecular formula of 3-Formyl-2-methylindole?
The molecular formula of 3-Formyl-2-methylindole is C10H9NO.
What is the molecular weight of 3-Formyl-2-methylindole?
The molecular weight of 3-Formyl-2-methylindole is 159.07 g/mol.
Where can I buy 3-Formyl-2-methylindole?
You can request a quote for 3-Formyl-2-methylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Formyl-2-methylindole?
Yes, KEHONG BIO provides custom synthesis services for 3-Formyl-2-methylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.