ChemicalBook--->CAS DataBase List--->108-13-4

108-13-4

108-13-4 Structure

108-13-4 Structure
IdentificationMore
[Name]

Malonamide
[CAS]

108-13-4
[Synonyms]

AURORA KA-4099
CARBOXAMIDOACETAMIDE
CARBOXYACETIC ACID DIAMIDE
DICARBOXYMETHANE DIAMIDE
LABOTEST-BB LT01598526
MALONAMIDE
MALONDIAMIDE
MALONIC ACID AMIDE
MALONIC ACID DIAMIDE
MALONODIAMIDE
METHANEDICARBOXYLIC ACID DIAMIDE
PROPANEDIAMIDE
PROPANEDIOIC ACID DIAMIDE
malonicdiamide
Malonyldiamide
MALONAMIDE, FOR FLUORESCENCE
MALONAMIDE 99+%
Malonamide 98%
MALONAMIDE extrapure
3-Amino-3-oxopropanamide
[EINECS(EC#)]

203-553-8
[Molecular Formula]

C3H6N2O2
[MDL Number]

MFCD00008034
[Molecular Weight]

102.09
[MOL File]

108-13-4.mol
Chemical PropertiesBack Directory
[Appearance]

White crystalline powder
[Melting point ]

172-175 °C (lit.)
[Boiling point ]

191.38°C (rough estimate)
[density ]

1.3516 (rough estimate)
[refractive index ]

1.5110 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Soluble in HCl.
[form ]

powder to crystal
[pka]

7.00±0.70(Predicted)
[color ]

White to Almost white
[Water Solubility ]

180 g/L (20 ºC)
[BRN ]

1751401
[InChI]

InChI=1S/C3H6N2O2/c4-2(6)1-3(5)7/h1H2,(H2,4,6)(H2,5,7)
[InChIKey]

WRIRWRKPLXCTFD-UHFFFAOYSA-N
[SMILES]

C(N)(=O)CC(N)=O
[CAS DataBase Reference]

108-13-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Propanediamide(108-13-4)
[EPA Substance Registry System]

108-13-4(EPA Substance)
Safety DataBack Directory
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

2
[RTECS ]

ON9125000
[TSCA ]

Yes
[HS Code ]

29241900
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

2-PHENYLMALONAMIDE-->4,6-DIBROMOPYRIMIDINE-->2-(TRIFLUOROMETHYL)PYRIMIDINE-4,6-DIOL-->2-Bromomalonamide-->4,6-Pyrimidinediol, 2-(fluoromethyl)- (6CI,8CI)-->2-Difluoromethyl-6-hydroxy-3H-pyrimidin-4-one
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Malonamide(108-13-4).msds
Hazard InformationBack Directory
[Hazard]

Mildly toxic by ingestion.
[Description]

Malonamide is a dicarboxylic acid diamide that is malonic acid in which both carboxy groups have been replaced by carbamoyl groups. It is functionally related to a malonic acid.
[Chemical Properties]

White crystalline powder
[Uses]

Malonamide is a reagent for fluorimetric determination of reducing carbohydrates. The malonamide-based ionic liquid extractant was used in the extraction of europium(iii) and other trivalent rare earth elements from nitric acid medium.
[Uses]

Malonamide is used in the synthesis of malonamic acid, malonamate and malonamide derivative of some heterocyclic compounds with antiinflammatory activity.
[Definition]

ChEBI: Malonamide is a dicarboxylic acid diamide that is malonic acid in which both carboxy groups have been replaced by carbamoyl groups. It is functionally related to a malonic acid.
[General Description]

The malonamide derivatives are obtained by the one-pot, five-component condensation reaction of isocyanide, Meldrum′s acid, arylidene malononitrile, and two amine molecules in CH2Cl2.
[Synthesis]

The synthesis of Malonamide is as follows:
A typical reaction was carried out in a 10 mL flask. Benzonitrile (2 mmol), CuII-4 ? (0.2 g), acetaldoxime (6 mmol) and MeOH (4 mL) were stirred at 65 °C for 4 h. The solid was filtered, washed with MeOH and the filtrate evaporated. The residue was subjected to GC-MS analysis and NMR spectroscopy. The filtered catalyst can be recycled after drying at about 150 °C for 1 h.
synthesis of Malonamide.png
[Purification Methods]

Crystallise the amide from water. [Beilstein 2 IV 1887.]
Spectrum DetailBack Directory
[Spectrum Detail]

Malonamide(108-13-4)MS
Malonamide(108-13-4)1HNMR
Malonamide(108-13-4)13CNMR
Malonamide(108-13-4)IR1
Malonamide(108-13-4)IR2
Malonamide(108-13-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Malonamide, 97%(108-13-4)
[Alfa Aesar]

Malonamide, 98%(108-13-4)
[Sigma Aldrich]

108-13-4(sigmaaldrich)
[TCI AMERICA]

Malonamide,>98.0%(N)(108-13-4)
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