ChemicalBook--->CAS DataBase List--->607-97-6

607-97-6

607-97-6 Structure

607-97-6 Structure
IdentificationMore
[Name]

Ethyl 2-ethylacetoacetate
[CAS]

607-97-6
[Synonyms]

2-Ethyl-3-oxo-butanoic acid ethyl ester
2-ETHYLACETOACETIC ACID ETHYL ESTER
ETHYL 2-ACETYLBUTYRATE
ETHYL 2-ETHYLACETOACETATE
ETHYL A-ETHYLACETOACETATE
ETHYL ALPHA-ETHYLACETOACETATE
ETHYL ETHYL ACETOACETATE
2-ethyl-3-oxo-butanoicaciethylester
2-ethyl-3-oxo-butyricacidethylester
Acetoacetic acid, 2-ethyl-, ethyl ester
Ethyl 2-ethyl-3-ketobutyrate
Ethyl 2-ethyl-3-oxobutanoate
Ethyl alpha-acetylbutyrate
Butanoic acid, 2-ethyl-3-oxo-, ethyl ester
Ethyl 2-ethyl-3-oxobutanoate:Diethyl acetoacetate
Ethyl 2-ethylacetoacetonate, 95%
ETHYL 2-ETHYLACETOACETAT
Ethyl 2-ethylacetylacetate
Ethyl a-acetylbutyrate
2-Acetylbutanoic acid ethyl ester
[EINECS(EC#)]

210-151-6
[Molecular Formula]

C8H14O3
[MDL Number]

MFCD00039898
[Molecular Weight]

158.19
[MOL File]

607-97-6.mol
Chemical PropertiesBack Directory
[Melting point ]

170 °C (decomp)
[Boiling point ]

87-189 °C/743 mmHg (lit.)
[density ]

0.981 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.421(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Liquid
[pka]

12.02±0.46(Predicted)
[color ]

Colorless to pale yellow
[Odor]

at 100.00 %. fruity winey green herbal earthy rootbeer ethereal
[Odor Type]

fruity
[BRN ]

636286
[InChI]

1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3
[InChIKey]

OKANYBNORCUPKZ-UHFFFAOYSA-N
[SMILES]

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

1.595 (est)
[CAS DataBase Reference]

607-97-6(CAS DataBase Reference)
[NIST Chemistry Reference]

Butanoic acid, 2-ethyl-3-oxo-, ethyl ester(607-97-6)
[EPA Substance Registry System]

607-97-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

1
[TSCA ]

Yes
[HazardClass ]

IRRITANT
[HS Code ]

29183000
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Diethyl sulfate
[Preparation Products]

4-[2-[(3-Ethyl-4-methyl-2-oxo-3-pyrrolin-1-yl)carboxamido]ethyl]benzenesulfonamide-->Ethyl 3-ethoxybut-2-enoate-->Butanamide, 2-ethyl-3-oxo- (9CI)-->2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Ethyl 2-ethylacetoacetate(607-97-6).msds
Hazard InformationBack Directory
[Uses]

Ethyl 2-ethylacetoacetate was used in the synthesis of 2-alkylidenetetrahydrofurans, diphenyllead(IV) thiosemicarbazonates and pyrazolonates. It was used as starting reagent in the synthesis of 2-ethylfumaric acid.
[Synthesis Reference(s)]

Synthetic Communications, 10, p. 279, 1980 DOI: 10.1080/00397918008062751
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl 2-ethylacetoacetate(607-97-6)MS
Ethyl 2-ethylacetoacetate(607-97-6)1HNMR
Ethyl 2-ethylacetoacetate(607-97-6)13CNMR
Ethyl 2-ethylacetoacetate(607-97-6)IR1
Ethyl 2-ethylacetoacetate(607-97-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

607-97-6(sigmaaldrich)
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