ChemicalBook--->CAS DataBase List--->40742-02-7

40742-02-7

40742-02-7 Structure

40742-02-7 Structure
IdentificationBack Directory
[Name]

4,4''-Benzoindicarboxylic acid dimethyl ester
[CAS]

40742-02-7
[Synonyms]

Dimethyl 4,4’-(2-Hydroxyacetyl)dibenzoate
4,4''-Benzoindicarboxylic acid dimethyl ester
dimethyl 4,4′-(1-hydroxy-2-oxoethane-1,2-diyl)dibenzoate
Benzoic acid, 4,4'-(1-hydroxy-2-oxo-1,2-ethanediyl)bis-, 1,1'-methyl ester
[Molecular Formula]

C18H16O6
[MDL Number]

MFCD31758394
[MOL File]

40742-02-7.mol
[Molecular Weight]

328.32
Chemical PropertiesBack Directory
[Melting point ]

140-141 °C
[Boiling point ]

514.5±45.0 °C(Predicted)
[density ]

1.283±0.06 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[pka]

11.37±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C18H16O6/c1-23-17(21)13-7-3-11(4-8-13)15(19)16(20)12-5-9-14(10-6-12)18(22)24-2/h3-10,15,19H,1-2H3
[InChIKey]

XFRIKHRKYHJNTP-UHFFFAOYSA-N
[SMILES]

C(C1C=CC(C(=O)OC)=CC=1)(O)C(C1C=CC(C(=O)OC)=CC=1)=O
Spectrum DetailBack Directory
[Spectrum Detail]

4,4''-Benzoindicarboxylic acid dimethyl ester(40742-02-7)1HNMR
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