5-Nitroindoline
TL;DR: 5-Nitroindoline (CAS 32692-19-6) is a chemical compound with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2,3-dihydro-1H-indole
Also Known As: 5-Nitroindoline, 5-nitro-2,3-dihydro-1H-indole, 1H-Indole, 2,3-dihydro-5-nitro-, 5-nitroindolin, INDOLINE, 5-NITRO-
| Molecular Formula | C8H8N2O2 |
|---|---|
| Molecular Weight | 164.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.05858 |
| Heavy Atoms | 12 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 32692-19-6 |
|---|---|
| SMILES | C1CNC2=C1C=C(C=C2)[N+](=O)[O-] |
| InChIKey | WJQWYAJTPPYORB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Nitroindoline (CAS 32692-19-6), with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol. IUPAC: 5-nitro-2,3-dihydro-1H-indole.
Chemical Property Profile of 5-Nitroindoline
Property Insights of 5-Nitroindoline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitroindoline. With a topological polar surface area (TPSA) of 57.9 Ų, 5-Nitroindoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Nitroindoline 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 5-Nitroindoline?
The CAS number of 5-Nitroindoline is 32692-19-6.
What is the molecular formula of 5-Nitroindoline?
The molecular formula of 5-Nitroindoline is C8H8N2O2.
What is the molecular weight of 5-Nitroindoline?
The molecular weight of 5-Nitroindoline is 164.06 g/mol.
Where can I buy 5-Nitroindoline?
You can request a quote for 5-Nitroindoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitroindoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitroindoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.