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370215

Sigma-Aldrich

Methyl 3,5-dimethylbenzoate

98%

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About This Item

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

Pureté

98%

Forme

solid

Point d'ébullition

239-240 °C (lit.)

Pf

31-33 °C (lit.)

Densité

1.027 g/mL at 25 °C (lit.)

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

Catégories apparentées

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.

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)

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Consulter la Bibliothèque de documents

Oliver F Jeker et al.
Angewandte Chemie (International ed. in English), 51(14), 3474-3477 (2012-02-22)
Revised version: the first total synthesis of indoxamycin B leads to a stereochemical reassignment of the natural product. The synthetic route features an efficient carboannulation sequence to rapidly access the dihydroindenone system. Moreover, a series of Au(I)-catalyzed transformations served in
Molecularly imprinted polymers for the selective sequestering and sensing of ions.
The Johns Hopkins Medical Letter Health After 50, 18(4), 465-465 (1997)
A Markovac et al.
Journal of medicinal chemistry, 23(11), 1198-1201 (1980-11-01)
Four carbon isosteres related to the highly active 4-pyridylcarbinolamines were prepared and evaluated for suppressive antimalarial activity against Plasmodium berghei in mice. Three of the four examples possessed significant activity but were approximately one dose level less active than the
A L Jenkins et al.
Analytical chemistry, 71(2), 373-378 (1999-02-09)
The techniques of molecular imprinting and sensitized lanthanide luminescence have been combined to create the basis for a sensor that can selectively measure the hydrolysis product of the nerve agent Soman in water. The sensor functions by selectively and reversibly

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