ChemicalBook--->CAS DataBase List--->541-50-4

541-50-4

541-50-4 Structure

541-50-4 Structure
IdentificationBack Directory
[Name]

Acetoacetic Acid
[CAS]

541-50-4
[Synonyms]

ACETOACETATE
diacetic acid
3-oxobutanate
3-KETOBUTYRATE
acetoaceticaci
Acetoacitic acid
Acetoacetic Acid
acetylacetic acid
3-Oxobutyric acid
Arbidol Impurity 6
3-ketobutyric acid
3-oxobutanoic acid
acetoncarboxylic acid
Butanoic acid, 3-oxo-
beta-ketobutyric acid
Acetonecarboxylic acid
3-ketobutanoic acid 3-oxobutanoic acid
[Molecular Formula]

C4H6O3
[MOL File]

541-50-4.mol
[Molecular Weight]

102.09
Chemical PropertiesBack Directory
[Melting point ]

36-37°
[Boiling point ]

131.37°C (rough estimate)
[density ]

1.1717 (rough estimate)
[refractive index ]

1.4540 (estimate)
[pka]

3.58(at 18℃)
[PH]

3.4(1 mM solution);2.83(10 mM solution);2.3(100 mM solution)
[LogP]

-0.467 (est)
Safety DataBack Directory
[RIDADR ]

1759
[HazardClass ]

8
[PackingGroup ]

III
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

7-HYDROXYCOUMARIN-4-ACETIC ACID-->2-ACETYL-ISONICOTINONITRILE-->Propanal, 2-oxo-, 1-oxime, (1E)-
Hazard InformationBack Directory
[Uses]

In organic syntheses.
[Definition]

ChEBI: A 3-oxo monocarboxylic acid that is butyric acid bearing a 3-oxo substituent.
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