370215

Methyl 3,5-dimethylbenzoate

98%

• Formule linéaire : (CH₃)₂C₆H₃CO₂CH₃
• CAS Number: 25081-39-4
• Poids moléculaire : 164.20
• Numéro MDL: MFCD00077971
• Code UNSPSC : 12352100
• ID de substance PubChem : 24863065
• Nomenclature NACRES : NA.22

Propriétés

• Niveau de qualité: 100
• Essai: 98%
• Forme: solid
• pb: 239-240 °C (lit.)
• Pf: 31-33 °C (lit.)
• Densité: 1.027 g/mL at 25 °C (lit.)
• Groupe fonctionnel: ester
• Chaîne SMILES: COC(=O)c1cc(C)cc(C)c1
• InChI: 1S/C10H12O2/c1-7-4-8(2)6-9(5-7)10(11)12-3/h4-6H,1-3H3
• Clé InChI: PEVXENGLERTHJE-UHFFFAOYSA-N

Description

Description générale

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-divinylbenzoate.

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.

Informations sur la sécurité

• Code de la classe de stockage: 11 - Combustible Solids
• Classe de danger pour l'eau (WGK): WGK 3
• Point d'éclair (°F): 224.6 °F - closed cup
• Point d'éclair (°C): 107.00 °C - closed cup
• Équipement de protection individuelle: Eyeshields, Gloves, type N95 (US)