Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate
TL;DR: Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate (CAS 24867-50-3) is a chemical compound with molecular formula C15H9N3O8 and molecular weight 359.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate
Also Known As: Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate, J1.213.140B, 9H-Fluorene-4-carboxylic acid, 2,5,7-trinitro-, methyl ester, 2,5,7-Trinitro-9H-fluorene-4-carboxylic acid methyl ester, 2,5,7-Trinitro-9-oxo-9H-fluorene-4-carboxylic acid methyl ester
| Molecular Formula | C15H9N3O8 |
|---|---|
| Molecular Weight | 359.04 g/mol |
| LogP | 2.769 |
| Topological Polar Surface Area | 155.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.03897 |
| Heavy Atoms | 26 |
| Complexity | 1014.43646 |
Chemical Identifiers
| CAS Number | 24867-50-3 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC2=C1C3=C(C2)C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate (CAS 24867-50-3), with molecular formula C15H9N3O8 and molecular weight 359.04 g/mol. IUPAC: methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate.
Chemical Property Profile of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate
Property Insights of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate
The XLogP value of 2.769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate. The TPSA of 155.72 Ų indicates high polarity, suggesting Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate has 0 hydrogen bond donor(s) and 8 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 Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate?
The CAS number of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate is 24867-50-3.
What is the molecular formula of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate?
The molecular formula of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate is C15H9N3O8.
What is the molecular weight of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate?
The molecular weight of Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate is 359.04 g/mol.
Where can I buy Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate?
You can request a quote for Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,5,7-trinitro-9H-fluorene-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.