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2065-27-2

2065-27-2 Structure

2065-27-2 Structure
IdentificationMore
[Name]

Methyl 2,6-dimethoxybenzoate
[CAS]

2065-27-2
[Synonyms]

2,6-DIMETHOXYBENZOIC ACID METHYL ESTER
METHYL 2,6-DIMETHOXYBENZOATE
RARECHEM AL BF 0201
METHYL 2,6-DIMETHOXYBENZATE
[Molecular Formula]

C10H12O4
[MDL Number]

MFCD00075861
[Molecular Weight]

196.2
[MOL File]

2065-27-2.mol
Chemical PropertiesBack Directory
[Melting point ]

87-90 °C (lit.)
[Boiling point ]

160-172 °C(Press: 14 Torr)
[density ]

1.119±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[Appearance]

Light yellow to brown Solid
[InChI]

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

XLXVNKPXOIYLLE-UHFFFAOYSA-N
[SMILES]

COC(=O)c1c(OC)cccc1OC
[CAS DataBase Reference]

2065-27-2(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzoic acid, 2,6-dimethoxy-, methyl ester(2065-27-2)
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

2918999090
[Storage Class]

13 - Non Combustible Solids
Hazard InformationBack Directory
[Uses]

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

Methyl 2,6-dimethoxybenzoate is a useful inter-mediate 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.
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 2,6-dimethoxybenzoate(2065-27-2)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

2065-27-2(sigmaaldrich)
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