ChemicalBook--->CAS DataBase List--->2469-99-0

2469-99-0

2469-99-0 Structure

2469-99-0 Structure
IdentificationBack Directory
[Name]

3-Oxobutanenitrile
[CAS]

2469-99-0
[Synonyms]

ACETOACETONITRILE
3-oxobutanenitrile
3-oxobutyronitrile
Butanenitrile, 3-oxo-
3-Oxobutanenitrile,96%
[EINECS(EC#)]

219-590-8
[Molecular Formula]

C4H5NO
[MDL Number]

MFCD05861381
[MOL File]

2469-99-0.mol
[Molecular Weight]

83.09
Chemical PropertiesBack Directory
[Boiling point ]

92-94℃/10mm
[density ]

0.976±0.06 g/cm3(Predicted)
[refractive index ]

1.4285
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[form ]

Liquid
[pka]

10.31±0.10(Predicted)
[color ]

Colorless to pale yellow
[Water Solubility ]

Slightly soluble in water.
[CAS DataBase Reference]

2469-99-0
Safety DataBack Directory
[RIDADR ]

3276
[HazardClass ]

6.1
[PackingGroup ]

[HS Code ]

2926907090
Hazard InformationBack Directory
[Chemical Properties]

Acetylacetonitrile [2469-99-0], b-ketobutyronitrile, 3-oxo-butanenitrile, H3CCOCCH2 CN, Mr 83.09, bp 120 – 125℃ (101.3 kPa), can be obtained by hydrolysis of b-aminocrotononitrile. A potential application is the synthesis of 3-amino-5-methylisoxazole, which is an intermediate for various drugs.
[Uses]

3-?Oxobutanenitrile is a reagent used in the synthesis of pyrazolopyrimidinones as well as in the preparation of inhibitors of phosphopantetheine
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