1-Methyl-5-nitroindolin-2-one
TL;DR: 1-Methyl-5-nitroindolin-2-one (CAS 20870-89-7) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-nitro-3H-indol-2-one
Also Known As: 1-methyl-5-nitroindolin-2-one, 1-methyl-5-nitro-3H-indol-2-one, 1-methyl-5-nitro-oxindole, 1-methyl-5-nitro-indolin-2-one, 2H-Indol-2-one, 1,3-dihydro-1-methyl-5-nitro-
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 1.1137 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 428.06528 |
Chemical Identifiers
| CAS Number | 20870-89-7 |
|---|---|
| SMILES | CN1C(=O)CC2=C1C=CC(=C2)[N+](=O)[O-] |
Product Overview
1-Methyl-5-nitroindolin-2-one (CAS 20870-89-7), with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol. IUPAC: 1-methyl-5-nitro-3H-indol-2-one.
Chemical Property Profile of 1-Methyl-5-nitroindolin-2-one
Property Insights of 1-Methyl-5-nitroindolin-2-one
The XLogP value of 1.1137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-5-nitroindolin-2-one. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-5-nitroindolin-2-one. Following Lipinski's Rule of Five, 1-Methyl-5-nitroindolin-2-one has 0 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 1-Methyl-5-nitroindolin-2-one?
The CAS number of 1-Methyl-5-nitroindolin-2-one is 20870-89-7.
What is the molecular formula of 1-Methyl-5-nitroindolin-2-one?
The molecular formula of 1-Methyl-5-nitroindolin-2-one is C9H8N2O3.
What is the molecular weight of 1-Methyl-5-nitroindolin-2-one?
The molecular weight of 1-Methyl-5-nitroindolin-2-one is 192.05 g/mol.
Where can I buy 1-Methyl-5-nitroindolin-2-one?
You can request a quote for 1-Methyl-5-nitroindolin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-5-nitroindolin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-5-nitroindolin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.