2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline
TL;DR: 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline (CAS 681260-47-9) is a chemical compound with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline
Also Known As: 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline, 2-fluoro-4-nitro-N-[(oxolan-2-yl)methyl]aniline, (2-FLUORO-4-NITRO-PHENYL)-(TETRAHYDRO-FURAN-2-YL-METHYL)-AMINE
| Molecular Formula | C11H13FN2O3 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 2.3248 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.09102 |
| Heavy Atoms | 17 |
| Complexity | 419.1776 |
Chemical Identifiers
| CAS Number | 681260-47-9 |
|---|---|
| SMILES | C1CC(OC1)CNC2=C(C=C(C=C2)[N+](=O)[O-])F |
Product Overview
2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline (CAS 681260-47-9), with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol. IUPAC: 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline.
Chemical Property Profile of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline
Property Insights of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline
The XLogP value of 2.3248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline. Following Lipinski's Rule of Five, 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline has 1 hydrogen bond donor(s) and 4 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 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline?
The CAS number of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline is 681260-47-9.
What is the molecular formula of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline?
The molecular formula of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline is C11H13FN2O3.
What is the molecular weight of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline?
The molecular weight of 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline is 240.09 g/mol.
Where can I buy 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline?
You can request a quote for 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-fluoro-4-nitro-N-(oxolan-2-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.