Methyl 3,5-dimethylbenzoate
ALDRICH/370215 - 98%
CAS Number: 25081-39-4
Empirical Formula (Hill Notation): C10H12O2
Molecular Weight: 164.20
MDL Number: MFCD00077971
Linear Formula: (CH3)2C6H3CO2CH3
Product Type: Chemical
| assay | 98% |
| bp | 239-240 °C (lit.) |
| density | 1.027 g/mL at 25 °C (lit.) |
| form | solid |
| InChI | 1S/C10H12O2/c1-7-4-8(2)6- |
| InChI key | PEVXENGLERTHJE-UHFFFAOYSA |
| mp | 31-33 °C (lit.) |
| SMILES string | COC(=O)c1cc(C)cc(C)c1 |
| Application: | Methyl 3,5-dimethylbenzoate may be used in the preparation of four carbon isostere related to highly active 4-pyridinemethanols, which were subsequently evaluated for their antimalarial activity. It may be used in the total synthesis of (±)-indoxamycin B. |
| General description: | Methyl 3,5-dimethylbenzoate is an aromatic carboxylic acid ester. It was selected as ligand during monomer screening for the synthesis and investigation of various europium compounds containing pinacolyl methylphosphonate with different ligands. Methyl 3,5-dimethylbenzoate is reported as precursor of methyl-3,5-divinylbenzoat |
| Packaging: | 5 g in glass bottle |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | 224.6 °F - closed cup |
| Flash Point(C) | 107.00 °C - closed cup |
| Purity | 98% |
| bp | 239-240 °C (lit.) |
| mp | 31-33 °C (lit.) |
| Density | 1.027 g/mL at 25 °C (lit.) |
| UNSPSC | 12352100 |