ChemicalBook--->CAS DataBase List--->10601-80-6

10601-80-6

10601-80-6 Structure

10601-80-6 Structure
IdentificationMore
[Name]

ETHYL 3,3-DIETHOXYPROPIONATE
[CAS]

10601-80-6
[Synonyms]

3,3-DIETHOXYPROPIONIC ACID ETHYL ESTER
DEPE
ETHYL 3,3-DIETHOXYPROPANOATE
ETHYL 3,3-DIETHOXYPROPIONATE
Propanoic acid, 3,3-diethoxy-, ethyl ester
ETHYL 3,3-DIETHOXYPROPIONATE, TECH., 90%
3,3-Diethoxypropanoic acid, ethyl ester
malonaldehydic acid diethyl acetal ethyl ester
malonaldehydic acid ethyl ester diethylacetal
Ethy 3,3-diethoxypropanoate
[EINECS(EC#)]

234-223-1
[Molecular Formula]

C9H18O4
[MDL Number]

MFCD00009865
[Molecular Weight]

190.24
[MOL File]

10601-80-6.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

200-202 °C
[Boiling point ]

92-93 °C/13 mmHg (lit.)
[density ]

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

n20/D 1.411(lit.)
[Fp ]

184 °F
[storage temp. ]

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

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

Liquid
[color ]

Clear colorless
[Detection Methods]

GC
[BRN ]

1772110
[Stability:]

Hygroscopic
[InChI]

InChI=1S/C9H18O4/c1-4-11-8(10)7-9(12-5-2)13-6-3/h9H,4-7H2,1-3H3
[InChIKey]

SIALOQYKFQEKOG-UHFFFAOYSA-N
[SMILES]

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

2.260 (est)
[CAS DataBase Reference]

10601-80-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210e-P280a-P370+P378a-P501a-P210-P280-P370+P378-P403+P235-P501
[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 .
[WGK Germany ]

3
[F ]

10-21
[HS Code ]

29189900
[Storage Class]

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

Diethyl ether-->Triethyl orthoformate-->ZINC-->Ethyl bromoacetate-->Chlorotrimethylsilane-->(E)-1,1,1-Trichloro-4-ethoxy-but-3-en-2-one-->4-ethoxy-1,1,1-trichloro-3-buten-2-one
[Preparation Products]

2-Dimethylamino-pyrimidine-5-carboxylic acid-->2-Trifluoromethyl-pyrimidine-5-carbaldehyde-->4-Chloro-2-methylpyrimidine-->(2-(Trifluoromethyl)pyrimidin-5-yl)methanol-->2-(Trifluoromethyl)pyrimidin-5-amine-->(2-(Trifluoromethyl)pyrimidin-5-yl)methanamine-->2-(Trifluoromethyl)pyrimidine-5-carboxamide-->2-(Trifluoromethyl)pyrimidine-5-carbonyl chloride-->Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate-->2-(Trifluoromethyl)pyrimidine-5-carboxylic acid-->2-Amino-pyrimidine-5-carboxylic acid ethyl ester-->2-Aminopyrimidine-5-carboxylic acid-->Triethyl 1,3,5-benzenetricarboxylate-->3,3-Diethoxy-propionic acid-->3-Ethoxyacrylic acid-->3,3-Diethoxypropionitrile
Hazard InformationBack Directory
[Description]

Ethyl 3,3-diethoxypropionate is an organic compound that is synthesized from the reaction of diethyl malonate and chloroacetic acid in the presence of a base catalyst. This product has been shown to be an effective inhibitor of mitochondrial cytochrome c oxidase in vitro studies. Ethyl 3,3-diethoxypropionate also has been found to inhibit quinoline derivatives, such as erythromycin and tetracycline, which are involved in bacterial DNA synthesis. Furthermore, this product inhibits β-unsaturated aldehydes and allylation.
[Chemical Properties]

clear colorless liquid
[Uses]

Ethyl 3,3-diethoxypropionate participates in the Yb(OTf)3 catalyzed synthesis of dihydropyridines (DHPs).
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 47, p. 2216, 1982 DOI: 10.1021/jo00132a055
Synthesis, p. 274, 1988 DOI: 10.1055/s-1988-27541
[General Description]

Ethyl 3,3-diethoxypropionate participates in the Yb(OTf)3 catalyzed synthesis of dihydropyridines (DHPs).
Spectrum DetailBack Directory
[Spectrum Detail]

ETHYL 3,3-DIETHOXYPROPIONATE(10601-80-6)MS
ETHYL 3,3-DIETHOXYPROPIONATE(10601-80-6)1HNMR
ETHYL 3,3-DIETHOXYPROPIONATE(10601-80-6)13CNMR
ETHYL 3,3-DIETHOXYPROPIONATE(10601-80-6)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Ethyl 3,3-diethoxypropanoate, 98%(10601-80-6)
[Alfa Aesar]

Ethyl 3,3-diethoxypropionate, 96%(10601-80-6)
[Sigma Aldrich]

10601-80-6(sigmaaldrich)
[TCI AMERICA]

Ethyl 3,3-Diethoxypropionate,>95.0%(GC)(10601-80-6)
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