ChemicalBook--->CAS DataBase List--->2235-46-3

2235-46-3

2235-46-3 Structure

2235-46-3 Structure
IdentificationMore
[Name]

N,N-Diethylacetoacetamide
[CAS]

2235-46-3
[Synonyms]

3-OXOBUTYRIC ACID DIETHYLAMIDE
ACETOACETDIETHYLAMIDE
ACETOACETIC ACID DIETHYLAMIDE
AKOS BBS-00006457
DEAA
N-ACETOACETYLDIETHYLAMINE
N,N-DIETHYL-3-OXOBUTANAMIDE
N,N-DIETHYLACETOACETAMIDE
1-(Diethylcarbamoyl)-2-propanone
Acetoacetamide, N,N-diethyl-
Aceto-N,N-diethylacetamide
Butanamide,N,N-diethyl-3-oxo-
Diethylacetoacetamide
Diethylamid kyseliny acetoctove
diethylamidkyselinyacetoctove
n,n-diethyl-3-oxo-butanamid
n,n-diethyl-acetoacetamid
n,n-diethylacetylacetamide
N,N-diethyl-3-oxobutyramide
N,N-DIETHYLACETOACETAMIDE, WACKER QUALI-TY
[EINECS(EC#)]

218-792-3
[Molecular Formula]

C8H15NO2
[MDL Number]

MFCD00026728
[Molecular Weight]

157.21
[MOL File]

2235-46-3.mol
Chemical PropertiesBack Directory
[Appearance]

Clear yellow liquid
[Melting point ]

-73 °C
[Boiling point ]

76 °C(lit.)
[density ]

0.994 g/mL at 20 °C(lit.)
[vapor pressure ]

1.387Pa at 25℃
[refractive index ]

n20/D 1.471
[Fp ]

94 °C
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

clear liquid
[pka]

12.97±0.46(Predicted)
[color ]

yellow
[PH]

5-7 (10g/l, H2O, 20℃)
[explosive limit]

1%(V)
[Water Solubility ]

10g/L at 26℃
[Usage]

N,N-Diethylacetoacetamide is used as intermediate for the manufacture of insecticides, e.g. phosphamidon Product Data Sheet
[BRN ]

636486
[InChI]

1S/C8H15NO2/c1-4-9(5-2)8(11)6-7(3)10/h4-6H2,1-3H3
[InChIKey]

NTMXFHGYWJIAAE-UHFFFAOYSA-N
[SMILES]

CCN(CC)C(=O)CC(C)=O
[LogP]

0.41
[CAS DataBase Reference]

2235-46-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Butanamide, N,N-diethyl-3-oxo-(2235-46-3)
[EPA Substance Registry System]

2235-46-3(EPA Substance)
Safety DataBack Directory
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[RTECS ]

AK4025000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29241990
[Storage Class]

10 - Combustible liquids
[Hazardous Substances Data]

2235-46-3(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydrochloric acid-->Dichloromethane-->Thionyl chloride-->Ethyl acetoacetate-->Diethylamine-->tert-Butyl methyl ether-->Acetyl ketene
[Preparation Products]

a,a-Dichloro-N,N-Diethylacetylacetamide-->2,2-dichloro-N,N-diethyl-3-oxobutyramide
Hazard InformationBack Directory
[Chemical Properties]

Clear yellow liquid
[Uses]

N,N-Diethylacetoacetamide is a β-dicarbonyl compound that ?can be used to synthesize potent calcium channel blockers such as 2,6,6-trimethyl-3-diethylaminocarbonyl-4-aryl-5-oxo-1,4,5,6,7,8-hexahydroquinoline derivatives and N,N-diethyl-2,6,6-trimethyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide. It can also undergo Michael addition in the presence of bis(2,4-pentanedionato)nickel(II) catalyst.
[Uses]

N,N-Diethylacetoacetamide is an intermediate in the synthesis of Phosphamidon (E/Z mixture) (P353730), an organophosphate insecticide that acts as a cholinesterase inhibitor.
[Uses]

N,N-Diethylacetoacetamide is used as intermediate for the manufacture of insecticides, e.g. phosphamidon Product Data Sheet
[Flammability and Explosibility]

Flammable
Spectrum DetailBack Directory
[Spectrum Detail]

N,N-Diethylacetoacetamide(2235-46-3)MS
N,N-Diethylacetoacetamide(2235-46-3)1HNMR
N,N-Diethylacetoacetamide(2235-46-3)13CNMR
N,N-Diethylacetoacetamide(2235-46-3)IR1
N,N-Diethylacetoacetamide(2235-46-3)IR2
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

N,N-Diethylacetoacetamide, 97%(2235-46-3)
[Sigma Aldrich]

2235-46-3(sigmaaldrich)
[TCI AMERICA]

N,N-Diethylacetoacetamide,>95.0%(GC)(2235-46-3)
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