6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate
TL;DR: 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate (CAS 442871-69-4) is a chemical compound with molecular formula C13H8F4N2O5 and molecular weight 348.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-nitroquinolin-8-yl) 2,3,3,3-tetrafluoro-2-methoxypropanoate
Also Known As: 6-nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate, A2595/0110407, (6-nitroquinolin-8-yl) 2,3,3,3-tetrafluoro-2-methoxypropanoate, 6-Nitro-8-quinolinyl 2,3,3,3-tetrafluoro-2-methoxypropanoate #, 6-NITRO-8-QUINOLYL 2,3,3,3-TETRAFLUORO-2-METHOXYPROPANOATE
| Molecular Formula | C13H8F4N2O5 |
|---|---|
| Molecular Weight | 348.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 94.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.03693 |
| Heavy Atoms | 24 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 442871-69-4 |
|---|---|
| SMILES | COC(C(=O)OC1=C2C(=CC(=C1)[N+](=O)[O-])C=CC=N2)(C(F)(F)F)F |
| InChIKey | LTJWGAITRHDDBQ-UHFFFAOYSA-N |
Product Overview
6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate (CAS 442871-69-4), with molecular formula C13H8F4N2O5 and molecular weight 348.04 g/mol. IUPAC: (6-nitroquinolin-8-yl) 2,3,3,3-tetrafluoro-2-methoxypropanoate.
Chemical Property Profile of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate
Property Insights of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate
The XLogP value of 3.1 indicates that 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate. Following Lipinski's Rule of Five, 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate has 0 hydrogen bond donor(s) and 10 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 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate?
The CAS number of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate is 442871-69-4.
What is the molecular formula of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate?
The molecular formula of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate is C13H8F4N2O5.
What is the molecular weight of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate?
The molecular weight of 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate is 348.04 g/mol.
Where can I buy 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate?
You can request a quote for 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitroquinolin-8-yl 2,3,3,3-tetrafluoro-2-methoxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.