9-Ethyl-4,6-dinitrocarbazol-3-amine
TL;DR: 9-Ethyl-4,6-dinitrocarbazol-3-amine (CAS 80776-33-6) is a chemical compound with molecular formula C14H12N4O4 and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-4,6-dinitrocarbazol-3-amine
Also Known As: 9-ethyl-4,6-dinitrocarbazol-3-amine, 9H-carbazol-3-amine,9-ethyl-4,6-dinitro-, 9-ETHYL-4,6-DINITRO-9H-CARBAZOL-3-AMINE
| Molecular Formula | C14H12N4O4 |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.08585 |
| Heavy Atoms | 22 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 80776-33-6 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=C1C=CC(=C3[N+](=O)[O-])N |
| InChIKey | MVBNOHHPXIRQEU-UHFFFAOYSA-N |
Product Overview
9-Ethyl-4,6-dinitrocarbazol-3-amine (CAS 80776-33-6), with molecular formula C14H12N4O4 and molecular weight 300.09 g/mol. IUPAC: 9-ethyl-4,6-dinitrocarbazol-3-amine.
Chemical Property Profile of 9-Ethyl-4,6-dinitrocarbazol-3-amine
Property Insights of 9-Ethyl-4,6-dinitrocarbazol-3-amine
The XLogP value of 3.2 indicates that 9-Ethyl-4,6-dinitrocarbazol-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Ethyl-4,6-dinitrocarbazol-3-amine. Following Lipinski's Rule of Five, 9-Ethyl-4,6-dinitrocarbazol-3-amine has 1 hydrogen bond donor(s) and 5 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-4,6-dinitrocarbazol-3-amine?
The CAS number of 9-Ethyl-4,6-dinitrocarbazol-3-amine is 80776-33-6.
What is the molecular formula of 9-Ethyl-4,6-dinitrocarbazol-3-amine?
The molecular formula of 9-Ethyl-4,6-dinitrocarbazol-3-amine is C14H12N4O4.
What is the molecular weight of 9-Ethyl-4,6-dinitrocarbazol-3-amine?
The molecular weight of 9-Ethyl-4,6-dinitrocarbazol-3-amine is 300.09 g/mol.
Where can I buy 9-Ethyl-4,6-dinitrocarbazol-3-amine?
You can request a quote for 9-Ethyl-4,6-dinitrocarbazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Ethyl-4,6-dinitrocarbazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-Ethyl-4,6-dinitrocarbazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.