2-methyl-5-nitro-1H-indole-3-carbaldehyde
TL;DR: 2-methyl-5-nitro-1H-indole-3-carbaldehyde (CAS 287172-63-8) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-nitro-1H-indole-3-carbaldehyde
Also Known As: 2-Methyl-5-nitro-1H-indole-3-carbaldehyde, 3-formyl-2-methyl-5-nitroindole, 2-methyl-5-nitro-3-formylindol, TIMTEC-BB SBB003510, 2-methyl-3-formyl-5-nitroindole
| Molecular Formula | C10H8N2O3 |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 78.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.0535 |
| Heavy Atoms | 15 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 287172-63-8 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=O |
| InChIKey | IKBFYOQMSYXGBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-methyl-5-nitro-1H-indole-3-carbaldehyde (CAS 287172-63-8), with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol. IUPAC: 2-methyl-5-nitro-1H-indole-3-carbaldehyde.
Chemical Property Profile of 2-methyl-5-nitro-1H-indole-3-carbaldehyde
Property Insights of 2-methyl-5-nitro-1H-indole-3-carbaldehyde
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-nitro-1H-indole-3-carbaldehyde. The TPSA of 78.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-nitro-1H-indole-3-carbaldehyde. Following Lipinski's Rule of Five, 2-methyl-5-nitro-1H-indole-3-carbaldehyde has 1 hydrogen bond donor(s) and 3 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-methyl-5-nitro-1H-indole-3-carbaldehyde?
The CAS number of 2-methyl-5-nitro-1H-indole-3-carbaldehyde is 287172-63-8.
What is the molecular formula of 2-methyl-5-nitro-1H-indole-3-carbaldehyde?
The molecular formula of 2-methyl-5-nitro-1H-indole-3-carbaldehyde is C10H8N2O3.
What is the molecular weight of 2-methyl-5-nitro-1H-indole-3-carbaldehyde?
The molecular weight of 2-methyl-5-nitro-1H-indole-3-carbaldehyde is 204.05 g/mol.
Where can I buy 2-methyl-5-nitro-1H-indole-3-carbaldehyde?
You can request a quote for 2-methyl-5-nitro-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 2-methyl-5-nitro-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-5-nitro-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.