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A24001

Acrolein diethyl acetal

Name: Acrolein diethyl acetal
Brand: ALDRICH

96%

Synonym(s):

3,3-Diethoxy-1-propene

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About This Item

Linear Formula:

CH₂=CHCH(OCH₂CH₃)₂

CAS Number:

3054-95-3

Molecular Weight:

130.18

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24890652

EC Number:

221-276-0

Beilstein/REAXYS Number:

1701567

MDL number:

MFCD00009239

Assay:

96%

Form:

liquid

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Properties

Quality Segment

200

assay

96%

form

liquid

refractive index

n20/D 1.398 (lit.)

bp

125 °C (lit.)

density

0.854 g/mL at 25 °C (lit.)

functional group

ether

SMILES string

CCOC(OCC)C=C

InChI

1S/C7H14O2/c1-4-7(8-5-2)9-6-3/h4,7H,1,5-6H2,2-3H3

InChI key

MCIPQLOKVXSHTD-UHFFFAOYSA-N

Description

Application

Acrolein diethyl acetal is widely used to carry out chemoselective Heck arylation to synthesize either 3-arylpropanoate esters or cinnamaldehyde derivatives.

It can also be used as one of the precursors to synthesize natural products like (−)-(Z)-Deoxypukalide, (−)-Laulimalide, botryodiplodin, neolaulimalide and isolaulimalide.

pictograms

GHS02,GHS07

signalword

Danger

hcodes

H225,H319

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2

Storage Class

3 - Flammable liquids

flash_point_f

59.0 °F - closed cup

flash_point_c

15 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

pcodes

P210 - P233 - P240 - P241 - P280 - P305 + P351 + P338

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