4,7-Difluoro-2-nitro-9h-fluoren-9-one
TL;DR: 4,7-Difluoro-2-nitro-9h-fluoren-9-one (CAS 29877-79-0) is a chemical compound with molecular formula C13H5F2NO3 and molecular weight 261.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-difluoro-2-nitrofluoren-9-one
Also Known As: 4,7-difluoro-2-nitro-9h-fluoren-9-one, NCIOpen2_006400, 4,7-difluoro-2-nitrofluoren-9-one, 9H-Fluoren-9-one,4,7-difluoro-2-nitro-, (9H-FLUOREN-9-YL)METHYL2-OXOETHYLCARBAMATE
| Molecular Formula | C13H5F2NO3 |
|---|---|
| Molecular Weight | 261.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 261.02374 |
| Heavy Atoms | 19 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 29877-79-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1F)C(=O)C3=C2C(=CC(=C3)[N+](=O)[O-])F |
| InChIKey | LEMSRARECSIWDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7-Difluoro-2-nitro-9h-fluoren-9-one (CAS 29877-79-0), with molecular formula C13H5F2NO3 and molecular weight 261.02 g/mol. IUPAC: 4,7-difluoro-2-nitrofluoren-9-one.
Chemical Property Profile of 4,7-Difluoro-2-nitro-9h-fluoren-9-one
Property Insights of 4,7-Difluoro-2-nitro-9h-fluoren-9-one
The XLogP value of 3.0 indicates that 4,7-Difluoro-2-nitro-9h-fluoren-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,7-Difluoro-2-nitro-9h-fluoren-9-one. Following Lipinski's Rule of Five, 4,7-Difluoro-2-nitro-9h-fluoren-9-one has 0 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 4,7-Difluoro-2-nitro-9h-fluoren-9-one?
The CAS number of 4,7-Difluoro-2-nitro-9h-fluoren-9-one is 29877-79-0.
What is the molecular formula of 4,7-Difluoro-2-nitro-9h-fluoren-9-one?
The molecular formula of 4,7-Difluoro-2-nitro-9h-fluoren-9-one is C13H5F2NO3.
What is the molecular weight of 4,7-Difluoro-2-nitro-9h-fluoren-9-one?
The molecular weight of 4,7-Difluoro-2-nitro-9h-fluoren-9-one is 261.02 g/mol.
Where can I buy 4,7-Difluoro-2-nitro-9h-fluoren-9-one?
You can request a quote for 4,7-Difluoro-2-nitro-9h-fluoren-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Difluoro-2-nitro-9h-fluoren-9-one?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Difluoro-2-nitro-9h-fluoren-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.