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About This Item
Linear Formula:
(CH3)2C=CHCOCl
CAS Number:
Molecular Weight:
118.56
Beilstein:
1560268
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
97%
form
liquid
contains
400 ppm phenothiazine as inhibitor
refractive index
n20/D 1.476 (lit.)
bp
145-147 °C (lit.)
density
1.065 g/mL at 25 °C (lit.)
functional group
acyl chloride
SMILES string
C\C(C)=C\C(Cl)=O
InChI
1S/C5H7ClO/c1-4(2)3-5(6)7/h3H,1-2H3
InChI key
BDUBTLFQHNYXPC-UHFFFAOYSA-N
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General description
3,3-Dimethylacryloyl chloride reacts with silylketene acetals in acetonitrile to give δ-ethylenic β-keto esters.
Application
3,3-Dimethylacryloyl chloride was used in the synthesis of:
- substituted 4,4-dimethyl-3,4-dihydro-1H-quinolin-2-one via condensation with aniline
- N-(3,3-Dimethylacryloyl)-(S)-leucine methyl ester
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B - STOT SE 3
Target Organs
Respiratory system
Supplementary Hazards
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
123.8 °F - closed cup
Flash Point(C)
51 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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