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470694

Methyl 2,6-dimethoxybenzoate

Name: Methyl 2,6-dimethoxybenzoate
Brand: ALDRICH

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About This Item

Linear Formula:

(CH₃O)₂C₆H₃CO₂CH₃

CAS Number:

2065-27-2

Molecular Weight:

196.20

NACRES:

NA.22

PubChem Substance ID:

24870671

UNSPSC Code:

12352100

MDL number:

MFCD00075861

Assay:

98%

Form:

solid

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Properties

assay

98%

form

solid

mp

87-90 °C (lit.)

functional group

ester

SMILES string

COC(=O)c1c(OC)cccc1OC

InChI

1S/C10H12O4/c1-12-7-5-4-6-8(13-2)9(7)10(11)14-3/h4-6H,1-3H3

InChI key

XLXVNKPXOIYLLE-UHFFFAOYSA-N

Description

General description

Methyl 2,6-dimethoxybenzoate is a useful intermediate for the synthesis of biologically active heterocyclic compounds. Its crystal structure has been investigated. Its molecule has a planar ester group which is at a dihedral angle of 81.46(3)° with respect to the benzene ring.

Application

Methyl 2,6-dimethoxybenzoate may be employed as starting reagent in the total synthesis of (±)-hyperforin.

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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