1-Nitrofluorene
TL;DR: 1-Nitrofluorene (CAS 55345-04-5) is a chemical compound with molecular formula C13H9NO2 and molecular weight 211.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitro-9H-fluorene
Also Known As: 1-Nitrofluorene, 1-nitro-9H-fluorene, Nitrofluorene, 9H-Fluorene, 1-nitro-, 9H-Fluorene, nitro-
| Molecular Formula | C13H9NO2 |
|---|---|
| Molecular Weight | 211.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.06332 |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 55345-04-5 |
|---|---|
| SMILES | C1C2=CC=CC=C2C3=C1C(=CC=C3)[N+](=O)[O-] |
| InChIKey | BEFAQJJPFPNXIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Nitrofluorene (CAS 55345-04-5), with molecular formula C13H9NO2 and molecular weight 211.06 g/mol. IUPAC: 1-nitro-9H-fluorene.
Chemical Property Profile of 1-Nitrofluorene
Property Insights of 1-Nitrofluorene
The XLogP value of 3.7 indicates that 1-Nitrofluorene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Nitrofluorene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitrofluorene has 0 hydrogen bond donor(s) and 2 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 1-Nitrofluorene?
The CAS number of 1-Nitrofluorene is 55345-04-5.
What is the molecular formula of 1-Nitrofluorene?
The molecular formula of 1-Nitrofluorene is C13H9NO2.
What is the molecular weight of 1-Nitrofluorene?
The molecular weight of 1-Nitrofluorene is 211.06 g/mol.
Where can I buy 1-Nitrofluorene?
You can request a quote for 1-Nitrofluorene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitrofluorene?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitrofluorene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.