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691-64-5

691-64-5 Structure

691-64-5 Structure
IdentificationBack Directory
[Name]

DI-TERT-BUTYL OXALATE
[CAS]

691-64-5
[Synonyms]

Di-t-butyl Oxalate
itert-butyloxalate
DI-TERT-BUTYL OXALATE
ditert-butyl ethanedioate
Di-tert-butyl oxalate 99%
Bis(1,1-dimethylethyl) oxalate
Oxalic acid di-tert-butyl ester
Oxalic acid bis(1,1-dimethylethyl) ester
Ethanedioic acid, 1,2-bis(1,1-dimethylethyl) ester
[EINECS(EC#)]

211-723-8
[Molecular Formula]

C10H18O4
[MDL Number]

MFCD00008806
[MOL File]

691-64-5.mol
[Molecular Weight]

202.25
Chemical PropertiesBack Directory
[Melting point ]

69-72 °C (lit.)
[Boiling point ]

229 °C
[density ]

1.007±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[Appearance]

White to off-white Solid
[BRN ]

1774415
[InChI]

1S/C10H18O4/c1-9(2,3)13-7(11)8(12)14-10(4,5)6/h1-6H3
[InChIKey]

CIYGMWIAXRMHQS-UHFFFAOYSA-N
[SMILES]

CC(C)(C)OC(=O)C(=O)OC(C)(C)C
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Hazard InformationBack Directory
[Uses]

Di-tert-butyl oxalate was used in preparation of disodium salt of 2-[(dihydroxyphosphinyl) difluoromethyl] propenoic acid.
[General Description]

Di-tert-butyl oxalate is an ester.
Spectrum DetailBack Directory
[Spectrum Detail]

DI-TERT-BUTYL OXALATE(691-64-5)1HNMR
DI-TERT-BUTYL OXALATE(691-64-5)13CNMR
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