![N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline structure](/static/products/6590/65907-72-4.webp)
N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline
TL;DR: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline (CAS 65907-72-4) is a chemical compound with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline
Also Known As: BAS 01125341, N-(4,5-dimethoxy-2-nitrobenzyl)aniline, N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline, (4,5-Dimethoxy-2-nitro-benzyl)-phenyl-amine, [(4,5-dimethoxy-2-nitrophenyl)methyl]phenylamine
| Molecular Formula | C15H16N2O4 |
|---|---|
| Molecular Weight | 288.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 76.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.111 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 65907-72-4 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)CNC2=CC=CC=C2)[N+](=O)[O-])OC |
| InChIKey | QLYMKBTYZRVWQY-UHFFFAOYSA-N |
Product Overview
N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline (CAS 65907-72-4), with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol. IUPAC: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline.
Chemical Property Profile of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline
Property Insights of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline
The XLogP value of 3.2 indicates that N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline. Following Lipinski's Rule of Five, N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline has 1 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 N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline?
The CAS number of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline is 65907-72-4.
What is the molecular formula of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline?
The molecular formula of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline is C15H16N2O4.
What is the molecular weight of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline?
The molecular weight of N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline is 288.11 g/mol.
Where can I buy N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline?
You can request a quote for N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(4,5-dimethoxy-2-nitrophenyl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.