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Acrolein diethyl acetal

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Name

Acrolein diethyl acetal

EINECS 221-276-0
CAS No. 3054-95-3 Density 0.854 g/cm3
PSA 18.46000 LogP 1.57150
Solubility Soluble in water Melting Point 120-125°C
Formula C7H14O2 Boiling Point 123.5 °C at 760 mmHg
Molecular Weight 130.187 Flash Point 22.3 °C
Transport Information UN 2374 3/PG 2 Appearance clear colorless liquid
Safety 9-16-26-33-29-7/9 Risk Codes 11-36
Molecular Structure Molecular Structure of 3054-95-3 (Acrolein diethyl acetal) Hazard Symbols FlammableF,IrritantXi
Synonyms

Acrolein,diethyl acetal (7CI,8CI);Propene, 3,3-diethoxy- (8CI);1,1-Diethoxy-2-propene;3,3-Diethoxy-1-propene;3,3-Diethoxypropene;Acrylylaldehyde diethyl acetal;Propenal diethyl acetal;

Article Data 37

Acrolein diethyl acetal Synthetic route

41365-75-7

aminopropane diethyl acetal

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With 2-hydroxynitrobenzene; strontium chloride; sodium sulfite In acetonitrile at 135℃; for 9h; Temperature; Time;83%
122-51-0

orthoformic acid triethyl ester

107-02-8

acrolein

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With toluene-4-sulfonic acid74%
With perchloric acid In ethanol for 0.5h;60%
With toluene-4-sulfonic acid In ethanol48%

phenylmagnesium bromide

A

292638-84-7

styrene

B

3054-95-3

acrylaldehyde diethyl acetal

C

14093-65-3

α-phenylallyl ethyl ether

Conditions
ConditionsYield
1,3-bis[(diphenylphosphino)propane]dichloronickel(II) In tetrahydrofuran at 0℃; for 3h;A 11%
B 55%
C 11%
35573-93-4

3-chloro-1,1-diethoxy-propane

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With potassium hydroxide
With alkali
With potassium tert-butylate
With alkali Darst.;
856983-92-1

3-butoxy-propionaldehyde diethylacetal

A

3054-95-3

acrylaldehyde diethyl acetal

B

1-ethoxy-3-butoxy-propene

Conditions
ConditionsYield
analog der Verbindung /BRN= 1738268/;ensteht ein Gemisch der Stereoisomeren;
3400-55-3

2-bromopropionaldehyde diethyl acetal

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With alkaline solution
With potassium tert-butylate In tert-butyl alcohol
64-17-5

ethanol

107-02-8

acrolein

A

7789-92-6

1,1,3-Triethoxy-propane

B

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With dichloromethane; ammonium chloride
64-17-5

ethanol

107-02-8

acrolein

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With aluminum oxide; silica gel; zirconium(IV) oxide
With toluene-4-sulfonic acid; Petroleum ether
With toluene-4-sulfonic acid
64-17-5

ethanol

78238-85-4, 78238-86-5

(1R,2R)-1-Bromo-2-ethoxy-cyclopropane

3054-95-3

acrylaldehyde diethyl acetal

Conditions
ConditionsYield
With potassium carbonate Heating; Yield given;
3400-55-3

2-bromopropionaldehyde diethyl acetal

diluted KOH-solution

diluted KOH-solution

3054-95-3

acrylaldehyde diethyl acetal

Acrolein diethyl acetal Chemical Properties

IUPAC Name: 3,3-Diethoxyprop-1-ene
Synonyms of Acrolein diethyl acetal (CAS NO.3054-95-3): 1,1-Diethoxy-2-propene ; 1,1-Diethoxy-2-propene ; 3,3-Diethoxy-1-propene ; 3,3-Diethoxypropene ; Acrolein diethyl acetal ; Acrylaldehyde diethyl acetal ; Propenal diethyl acetal ; 1-Propene, 3,3-diethoxy- ; 1-Propene, 3,3-diethoxy- (9CI) ; Acrolein, diethyl acetal (8CI)
CAS NO: 3054-95-3
Molecular Formula: C7H14O2
Molecular Weight: 130.18
Molecular Structure:
EINECS: 221-276-0
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 18.46 Å2
Index of Refraction: 1.409
Molar Refractivity: 37.65 cm3
Molar Volume: 152.2 cm3
Surface Tension: 23.8 dyne/cm
Density: 0.854 g/cm3
Flash Point: 22.3 °C
Enthalpy of Vaporization: 34.65 kJ/mol
Boiling Point: 123.5 °C at 760 mmHg
Vapour Pressure: 16 mmHg at 25°C
Storage temp: 2-8°C
Appearance: clear colorless liquid
SMILES: C=CC(OCC)OCC
Product Categories of Acrolein diethyl acetal (CAS NO.3054-95-3): Pharmaceutical Intermediates;pharmacetical

Acrolein diethyl acetal Uses

 Acrolein diethyl acetal (CAS NO.3054-95-3) is used as an important intermediate in the pharmaceutical, dyes and organic synthesis industry.

Acrolein diethyl acetal Toxicity Data With Reference

1.    

mma-sat 5 µg/plate

    TCMUD8    Teratogenesis, Carcinogenesis, and Mutagenesis. 1 (1980),259.

Acrolein diethyl acetal Safety Profile

Safty informations about Acrolein diethyl acetal (CAS NO.3054-95-3):
Hazard Codes: IrritantXiFlammableF
Risk Statements:11-36
11: Highly Flammable
36: Irritating to the eyes
Safety Statements: 9-16-26-33-29-7/9
9: Keep container in a well-ventilated place
16: Keep away from sources of ignition-No smoking
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
33: Take precautionary measures against static discharges
29: Do not empty into drains
7/9: Keep container tightly closed and in a well-ventilated place
RIDADR: UN 2374 3/PG 2
WGK Germany: 3
RTECS: AS1370000
F: 8-13
HazardClass: 3
Mutation data reported. A flammable liquid. A dangerous fire hazard when exposed to heat, flame, or oxidizers. When heated to decomposition it emits acrid smoke and fumes.

Acrolein diethyl acetal Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

Acrolein diethyl acetal Specification

Handling and Storage:
Storage: Keep Acrolein diethyl acetal in a cool, dry, dark location in a tightly sealed container or cylinder. Keep it away from incompatible materials, ignition sources and untrained individuals. Protect containers/cylinders from physical damage.
Handling: All chemicals should be considered hazardous. Avoid direct physical contact. Use appropriate, approved safety equipment. Untrained individuals should not handle this chemical or its container. Handling should occur in a chemical fume hood.

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