N-(3-Nitrophenyl)-4-methylbenzylamine
N-[(4-methylphenyl)methyl]-3-nitroaniline
Also Known As: n-(4-methylbenzyl)-3-nitroaniline|N-[(4-methylphenyl)methyl]-3-nitroaniline|3-nitro-N-(p-tolylmethyl)aniline|N-(3-NITROPHENYL)-4-METHYLBENZYLAMINE|653-761-1
CAS: 91-39-4
| Molecular Formula | C14H14N2O2 |
|---|---|
| Molecular Weight | 242.10553 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.10553 |
| Monoisotopic Mass | 242.10553 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 91-39-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | ANVKUDDLGAYXIW-UHFFFAOYSA-N |
Product Overview
N-(3-Nitrophenyl)-4-methylbenzylamine (CAS 91-39-4), with molecular formula C14H14N2O2 and molecular weight 242.10553 g/mol. IUPAC: N-[(4-methylphenyl)methyl]-3-nitroaniline.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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