ChemicalBook--->CAS DataBase List--->4949-44-4

4949-44-4

4949-44-4 Structure

4949-44-4 Structure
IdentificationMore
[Name]

Ethyl propionylacetate
[CAS]

4949-44-4
[Synonyms]

3-KETO-N-VALERIC ACID ETHYL ESTER
3-KETOVALERIC ACID ETHYL ESTER
3-OXOVALERIC ACID ETHYL ESTER
ETHYL 3-OXOPENTANOATE
ETHYL 3-OXOVALERATE
ETHYL PROPIONYLACETATE
PROPIONYLACETIC ACID ETHYL ESTER
3-oxo-pentanoicacidethylester
Ethyl 3-oxo-n-valerate
Pentanoic acid, 3-oxo-, ethyl ester
Ethylpropionylacetate,95%
Ethyl propionylacetate, 98+%
Ethyl propanoylacetate
thyl 3-ketopentanoate
[EINECS(EC#)]

225-593-5
[Molecular Formula]

C7H12O3
[MDL Number]

MFCD00009317
[Molecular Weight]

144.17
[MOL File]

4949-44-4.mol
Chemical PropertiesBack Directory
[Appearance]

colourless liquid
[Melting point ]

98 °C
[Boiling point ]

83-84 °C/12 mmHg (lit.)
[density ]

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

n20/D 1.422(lit.)
[Fp ]

172 °F
[storage temp. ]

Refrigerator
[solubility ]

Miscible with glacial acetic acid.
[form ]

Liquid
[pka]

10.58±0.46(Predicted)
[color ]

Clear colorless to pale yellow
[Specific Gravity]

1.01
[Stability:]

Stable. Combustible. Incompatible with strong oxidizing agents.
[BRN ]

970270
[InChIKey]

UDRCONFHWYGWFI-UHFFFAOYSA-N
[CAS DataBase Reference]

4949-44-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethyl propionylacetate(4949-44-4)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H335-H227-H315-H319
[Precautionary statements ]

P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501-P210e-P261-P280a-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29183000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

TRIPHENYLMETHYL SODIUM-->2,2-diMethyl-5-propanoyl-1,3-dioxane-4,6-dione-->Pentanoic acid, 2-diazo-3-hydroxy-, ethyl ester-->2-Oxazolidinone, 3-(1-oxopropyl)--->Carbon tetrachloride-->Iodomethane-->Ethyl acetate-->3-Propionylthiazolidine-2-thione-->Propionyl chloride-->Pentanoic acid,3-hydroxy-, ethyl ester-->3,5-Dimethyl-1-(1-Oxopropyl)-1H-Pyrazole-->4-Pentenoic acid, 3-hydroxy-, ethyl ester-->2,2-Dimethyl-1,3-dioxane-4,6-dione-->Diethyl malonate
[Preparation Products]

Etodolac-->ETHYL 4-FLUORO-3-OXOPENTANOATE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Ethyl 3-oxovalerate(4949-44-4).msds
Hazard InformationBack Directory
[Chemical Properties]

colourless liquid
[Uses]

An intermediate of Rosuvastatin.
[Synthesis Reference(s)]

Synthesis, p. 829, 1978 DOI: 10.1055/s-1978-24903
[General Description]

Ethyl propionylacetate reacts with tropolone p-toluenesulfonate in the presence of sodium ethoxide to give 3-propionyl-2H-cyclohepta[b]furan-2-one.
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl propionylacetate(4949-44-4)MS
Ethyl propionylacetate(4949-44-4)1HNMR
Ethyl propionylacetate(4949-44-4)13CNMR
Ethyl propionylacetate(4949-44-4)IR1
Ethyl propionylacetate(4949-44-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Ethyl propionylacetate, 98+%(4949-44-4)
[Alfa Aesar]

Ethyl propionylacetate, 95%(4949-44-4)
[Sigma Aldrich]

4949-44-4(sigmaaldrich)
[TCI AMERICA]

Ethyl 3-Oxovalerate,>97.0%(GC)(4949-44-4)
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