5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline
TL;DR: 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline (CAS 347355-88-8) is a chemical compound with molecular formula C11H9ClN2O3 and molecular weight 252.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline
Also Known As: 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline, (5-chloro-2-nitrophenyl)(2-furylmethyl)amine, N-(2-furylmethyl)-5-chloro-2-nitroaniline, AB00109201-01, (5-Chloro-2-nitro-phenyl)-furan-2-ylmethyl-amine
| Molecular Formula | C11H9ClN2O3 |
|---|---|
| Molecular Weight | 252.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.03017 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 347355-88-8 |
|---|---|
| SMILES | C1=COC(=C1)CNC2=C(C=CC(=C2)Cl)[N+](=O)[O-] |
| InChIKey | MPBPTAWINQRLFR-UHFFFAOYSA-N |
Product Overview
5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline (CAS 347355-88-8), with molecular formula C11H9ClN2O3 and molecular weight 252.03 g/mol. IUPAC: 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline.
Chemical Property Profile of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline
Property Insights of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline
The XLogP value of 3.5 indicates that 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline. Following Lipinski's Rule of Five, 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline 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 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline?
The CAS number of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline is 347355-88-8.
What is the molecular formula of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline?
The molecular formula of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline is C11H9ClN2O3.
What is the molecular weight of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline?
The molecular weight of 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline is 252.03 g/mol.
Where can I buy 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline?
You can request a quote for 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N-(furan-2-ylmethyl)-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.