ChemicalBook--->CAS DataBase List--->6044-68-4

6044-68-4

6044-68-4 Structure

6044-68-4 Structure
IdentificationMore
[Name]

Acrolein dimethyl acetal
[CAS]

6044-68-4
[Synonyms]

3,3-DIMETHOXY-1-PROPENE
ACROLEIN DIMETHYL ACETAL
1-Propene, 3,3-dimethoxy-
3,3-dimethoxy-1-propen
3,3-Dimethoxypropene-1
3,3-dimethoxypropene
Acroleindimethylacetal,99%
ACROLEIN DIMETHYL
1,1-Dimethoxyprop-2-ene
2-Propenal, dimethyl acetal
3,3-Dimethoxyprop-1-ene
Acrylaldehyde dimethyl acetal
Propenal dimethyl acetal
[EINECS(EC#)]

227-936-4
[Molecular Formula]

C5H10O2
[MDL Number]

MFCD00008632
[Molecular Weight]

102.13
[MOL File]

6044-68-4.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS LIQUID
[Boiling point ]

89-90 °C(lit.)
[density ]

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

n20/D 1.395(lit.)
[Fp ]

27 °F
[storage temp. ]

2-8°C
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[BRN ]

1700037
[InChI]

InChI=1S/C5H10O2/c1-4-5(6-2)7-3/h4-5H,1H2,2-3H3
[InChIKey]

OBWGMYALGNDUNM-UHFFFAOYSA-N
[SMILES]

C=CC(OC)OC
[LogP]

0.653 (est)
[CAS DataBase Reference]

6044-68-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Acrolein,dimethyl acetal(6044-68-4)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Danger
[Hazard statements ]

H225
[Precautionary statements ]

P210
[Hazard Codes ]

F
[Risk Statements ]

R11:Highly Flammable.
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S29:Do not empty into drains .
S33:Take precautionary measures against static discharges .
[RIDADR ]

UN 3384 6.1/PG 1
[WGK Germany ]

3
[RTECS ]

UC8500000
[HazardClass ]

3.1
[PackingGroup ]

II
[HS Code ]

2911000000
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 2
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,3-Dimethoxy-1-propene(6044-68-4).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLOURLESS LIQUID
[Uses]

Acrolein dimethyl acetal was used in the facile one step synthesis of 4-hydroxy-2E-nonenal and its dimethyl acetal via a cross-metathesis reaction with octen-3-ol.
[Purification Methods]

Fractionally distil it (after adding 0.5g of hydroquinone) under reduced pressure through an all glass column (40cm x 2.5 cm) packed with glass helices and provided with a heated jacket and a total reflux variable take-off head. Stainless steel Lessing rings (1/8 x 1/8 in) or gauze have also been used as packing. It is a highly flammable and TOXIC liquid; keep away from the skin. [Hall & Stern J Chem Soc 2657 1955, Beilstein 1 IV 3437.]
Spectrum DetailBack Directory
[Spectrum Detail]

Acrolein dimethyl acetal(6044-68-4)1HNMR
Acrolein dimethyl acetal(6044-68-4)13CNMR
Acrolein dimethyl acetal(6044-68-4)Raman
Acrolein dimethyl acetal(6044-68-4)IR
Acrolein dimethyl acetal(6044-68-4)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

6044-68-4(sigmaaldrich)
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