![3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline structure](/static/products/3558/355816-01-2.webp)
3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline
TL;DR: 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline (CAS 355816-01-2) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline
Also Known As: 3,4-dimethyl-N-(4-nitrobenzyl)aniline, 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline, BAS 01124909, (3,4-Dimethyl-phenyl)-(4-nitro-benzyl)-amine, AB00088593-01
| Molecular Formula | C15H16N2O2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.1212 |
| Heavy Atoms | 19 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 355816-01-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])C |
| InChIKey | SJUSWTVGSJPELZ-UHFFFAOYSA-N |
Product Overview
3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline (CAS 355816-01-2), with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol. IUPAC: 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline.
Chemical Property Profile of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline
Property Insights of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline
The XLogP value of 4.4 indicates that 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.9 Ų, 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline has 1 hydrogen bond donor(s) and 3 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 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline?
The CAS number of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline is 355816-01-2.
What is the molecular formula of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline?
The molecular formula of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline is C15H16N2O2.
What is the molecular weight of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline?
The molecular weight of 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline is 256.12 g/mol.
Where can I buy 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline?
You can request a quote for 3,4-dimethyl-N-[(4-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 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethyl-N-[(4-nitrophenyl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.