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Merck
CN

129712

Methyl 3-aminocrotonate

97%

Synonym(s):

Methyl 3-amino-2-butenoate

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About This Item

Linear Formula:
CH3C(NH2)=CHCOOCH3
CAS Number:
Molecular Weight:
115.13
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
238-056-5
Beilstein/REAXYS Number:
956592
MDL number:
Assay:
97%
Form:
solid
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Quality Segment

assay

97%

form

solid

mp

81-83 °C (lit.)

functional group

amine, ester

SMILES string

COC(=O)\C=C(\C)N

InChI

1S/C5H9NO2/c1-4(6)3-5(7)8-2/h3H,6H2,1-2H3/b4-3+

InChI key

XKORCTIIRYKLLG-ONEGZZNKSA-N

General description

Methyl 3-aminocrotonate undergoes waste-free solid-state cascade reaction with crystalline ninhydrin.

Application

Methyl 3-aminocrotonate (Methyl 3-amino-2-butenoate) was used to synthesize 4-aryl-1,4-dihydropyridines possessing potential calcium channel blocking activity.


pictograms

CorrosionExclamation mark

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Sens. 1

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

213.8 °F - closed cup

flash_point_c

101 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves



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