ChemicalBook--->CAS DataBase List--->53051-81-3

53051-81-3

53051-81-3 Structure

53051-81-3 Structure
IdentificationBack Directory
[Name]

DIETHYL MALONATE (1,2,3-13C3)
[CAS]

53051-81-3
[Synonyms]

NSC 8864-13C3
NSC 136903-13C3
Ethyl Malonate-13C3
Diethyl Malonate-13C3
[13C3]-Diethyl Malonate
DicarbethoxyMethane-13C3
ETHYL MALONATE(1,2,3-13C3)
Diethyl Propanedioate-13C3
Carbethoxyacetic Ester-13C3
Malonate Diethyl Ester-13C3
Diethyl malonate-1,2,3-13C?
13C Labeled diethyl malonate
DIETHYL MALONATE (1,2,3-13C3)
Malonic Acid Diethyl Ester-13C3
Diethyl Propane-1,3-dioate-13C3
13C Labeled diethyl malonic acid
[13C3]-Malonic Acid Diethyl Esther
Propanedioic Acid Diethyl Ester-13C3
Propanedioic Acid 1,3-Diethyl Ester-13C3
DIETHYL MALONATE-1,2,3-13C3, 99 ATOM % 1 3C
Methanedicarboxylic Acid Diethyl Ester-13C3
[Molecular Formula]

C7H12O4
[MDL Number]

MFCD00083938
[MOL File]

53051-81-3.mol
[Molecular Weight]

163.19
Chemical PropertiesBack Directory
[Melting point ]

−51-−50 °C(lit.)
[Boiling point ]

199 °C(lit.)
[density ]

1.074 g/mL at 25 °C
[refractive index ]

n20/D 1.414(lit.)
[Fp ]

212 °F
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Colourless
[InChI]

1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3/i5+1,6+1,7+1
[InChIKey]

IYXGSMUGOJNHAZ-SVFBATFISA-N
[SMILES]

CCO[13C](=O)[13CH2][13C](=O)OCC
[CAS Number Unlabeled]

105-53-3
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38-36
[Safety Statements ]

26-36
[RIDADR ]

UN 1993 / PGIII
[WGK Germany ]

3
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Hazard InformationBack Directory
[Chemical Properties]

Clear Colorless Oil
[Uses]

(Diethyl malonate-1,2,3-13C3) A labelled diethyl ester of malonic acid which occurs naturally in grapes and strawberries. It is used in the preparation of barbiturates, artificial flavourings, vitamin B1, and vitamin B6 as well as in perfumes.
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105-53-3