3,4-Dimethylbenzaldehyde
ALDRICH/493856 - 98%
CAS Number: 5973-71-7
Empirical Formula (Hill Notation): C9H10O
Molecular Weight: 134.18
EC Number: 227-770-2
MDL Number: MFCD00016612
Linear Formula: (CH3)2C6H3CHO
Product Type: Chemical
| assay | 98% |
| bp | 226 °C (lit.) |
| density | 1.012 g/mL at 25 °C (lit.) |
| InChI | 1S/C9H10O/c1-7-3-4-9(6-10 |
| InChI key | POQJHLBMLVTHAU-UHFFFAOYSA |
| refractive index | n |
| SMILES string | Cc1ccc(C=O)cc1C |
| Application: | 3,4-Dimethylbenzaldehyde may be used in the synthesis of 3,4-dimethylmethcathinone (DMMC) and 3,4-dimethyl-dibenzyliden |
| General description: | 3,4-Dimethylbenzaldehyde (3,4-DMB) is a benzaldehyde derivative. It is the OH radical initiated oxidative degradation product of trimethylbenzene. The rate coefficient of the gas-phase reaction between 3,4-DMB and OH radical is 24.6±4.0×10-12cm3molecule-1s-1. The vibrational analysis of 3,4-DMB based on FT-IR spectra, FT-Raman spectra, ab initio and density functional theory (DFT) calculations have been reported. It is formed as an intermediate during the transformation of furfural into gasoline-range fuels using ZSM(Zeolite Socony Mobil)-5-based catalysts. |
| Packaging: | 5 g in glass bottle |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | 98% |
| bp | 226 °C (lit.) |
| Density | 1.012 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |