8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one
TL;DR: 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one (CAS 332409-58-2) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one
Also Known As: BAS 00017981, 8-methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one, 8-methyl-5-nitro-2,3,4,9-tetrahydro-1H-carbazol-1-one, 8-Methyl-5-nitro-2,3,4,9-tetrahydro-carbazol-1-one, 8-methyl-5-nitro-2,3,4,9-tetrahydro-4aH-carbazol-1-one
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 2.90352 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 685.09143 |
Chemical Identifiers
| CAS Number | 332409-58-2 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)[N+](=O)[O-])C3=C(N2)C(=O)CCC3 |
Product Overview
8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one (CAS 332409-58-2), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: 8-methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one.
Chemical Property Profile of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one
Property Insights of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one
The XLogP value of 2.90352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one. Following Lipinski's Rule of Five, 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one 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 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one?
The CAS number of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one is 332409-58-2.
What is the molecular formula of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one?
The molecular formula of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one is C13H12N2O3.
What is the molecular weight of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one?
The molecular weight of 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one is 244.08 g/mol.
Where can I buy 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one?
You can request a quote for 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Methyl-5-nitro-2,3,4,9-tetrahydrocarbazol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.