3H-Indole, 2,3,3-trimethyl-5-nitro-
TL;DR: 3H-Indole, 2,3,3-trimethyl-5-nitro- (CAS 3484-22-8) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3-trimethyl-5-nitroindole
Also Known As: 2,3,3-Trimethyl-5-nitro-3H-indole, 5-Nitro-2,3,3-trimethylindolenine, 2,3,3-trimethyl-5-nitroindole, 3H-Indole, 2,3,3-trimethyl-5-nitro-, ChemDiv1_024461
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 3484-22-8 |
|---|---|
| SMILES | CC1=NC2=C(C1(C)C)C=C(C=C2)[N+](=O)[O-] |
| InChIKey | DDORSJSRAREODY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3H-Indole, 2,3,3-trimethyl-5-nitro- (CAS 3484-22-8), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: 2,3,3-trimethyl-5-nitroindole.
Chemical Property Profile of 3H-Indole, 2,3,3-trimethyl-5-nitro-
Property Insights of 3H-Indole, 2,3,3-trimethyl-5-nitro-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Indole, 2,3,3-trimethyl-5-nitro-. With a topological polar surface area (TPSA) of 58.2 Ų, 3H-Indole, 2,3,3-trimethyl-5-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Indole, 2,3,3-trimethyl-5-nitro- 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 3H-Indole, 2,3,3-trimethyl-5-nitro-?
The CAS number of 3H-Indole, 2,3,3-trimethyl-5-nitro- is 3484-22-8.
What is the molecular formula of 3H-Indole, 2,3,3-trimethyl-5-nitro-?
The molecular formula of 3H-Indole, 2,3,3-trimethyl-5-nitro- is C11H12N2O2.
What is the molecular weight of 3H-Indole, 2,3,3-trimethyl-5-nitro-?
The molecular weight of 3H-Indole, 2,3,3-trimethyl-5-nitro- is 204.09 g/mol.
Where can I buy 3H-Indole, 2,3,3-trimethyl-5-nitro-?
You can request a quote for 3H-Indole, 2,3,3-trimethyl-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indole, 2,3,3-trimethyl-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indole, 2,3,3-trimethyl-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.