1-Chloro-4-methyl-2-nitrobenzene

1-Chloro-4-methyl-2-nitrobenzene Structure
1-Chloro-4-methyl-2-nitrobenzene structure
Common Name 1-Chloro-4-methyl-2-nitrobenzene
CAS Number 89-60-1 Molecular Weight 171.581
Density 1.3±0.1 g/cm3 Boiling Point 264.8±20.0 °C at 760 mmHg
Molecular Formula C7H6ClNO2 Melting Point 7 °C(lit.)
MSDS Chinese USA Flash Point 113.9±21.8 °C
Symbol GHS07
GHS07
Signal Word Warning

FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on 4-chloro-3-nitrotoluene.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 89 , 137-48, (2012)

In this work, the vibrational spectral analysis was carried out by using Raman and infrared spectroscopy in the range 100-4000 cm(-1) and 50-4000 cm(-1), respectively, for 4-chloro-3-nitrotoluene (C7H6NO2Cl) molecule. The molecular structure, fundamental vibr...

Synthesis of imidazo[1,5,4-de]quinoxalin-9-ones, benzimidazole analogues of pyrroloiminoquinone marine natural products.

Bioorg. Med. Chem. 13(2) , 387-95, (2005)

The imidazoquinoxalinones 1 and 2 are benzimidazole analogues of indole-based marine natural products called makaluvamins. The stabilized cation 1 and the zwitterion 2 were prepared in approximately 9 steps from readily available starting materials. Compound ...