9-Ethyl-3,6-dinitro-9H-carbazole
TL;DR: 9-Ethyl-3,6-dinitro-9H-carbazole (CAS 53830-18-5) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-3,6-dinitrocarbazole
Also Known As: 9-Ethyl-3,6-dinitro-9H-carbazole, 9-ethyl-3,6-dinitrocarbazole, 3,6-Dinitro-9-ethyl-carbazole, 9H-Carbazole, 9-ethyl-3,6-dinitro-, 3,6-Dinitro-9-ethyl-9H-carbazole
| Molecular Formula | C14H11N3O4 |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 96.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.07495 |
| Heavy Atoms | 21 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 53830-18-5 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=C1C=CC(=C3)[N+](=O)[O-] |
| InChIKey | XMYZULFVNDPXLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Ethyl-3,6-dinitro-9H-carbazole (CAS 53830-18-5), with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol. IUPAC: 9-ethyl-3,6-dinitrocarbazole.
Chemical Property Profile of 9-Ethyl-3,6-dinitro-9H-carbazole
Property Insights of 9-Ethyl-3,6-dinitro-9H-carbazole
The XLogP value of 3.3 indicates that 9-Ethyl-3,6-dinitro-9H-carbazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Ethyl-3,6-dinitro-9H-carbazole. Following Lipinski's Rule of Five, 9-Ethyl-3,6-dinitro-9H-carbazole has 0 hydrogen bond donor(s) and 4 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 9-Ethyl-3,6-dinitro-9H-carbazole?
The CAS number of 9-Ethyl-3,6-dinitro-9H-carbazole is 53830-18-5.
What is the molecular formula of 9-Ethyl-3,6-dinitro-9H-carbazole?
The molecular formula of 9-Ethyl-3,6-dinitro-9H-carbazole is C14H11N3O4.
What is the molecular weight of 9-Ethyl-3,6-dinitro-9H-carbazole?
The molecular weight of 9-Ethyl-3,6-dinitro-9H-carbazole is 285.07 g/mol.
Where can I buy 9-Ethyl-3,6-dinitro-9H-carbazole?
You can request a quote for 9-Ethyl-3,6-dinitro-9H-carbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Ethyl-3,6-dinitro-9H-carbazole?
Yes, KEHONG BIO provides custom synthesis services for 9-Ethyl-3,6-dinitro-9H-carbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.