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CAS Number: 114431-72-0
(E)-methyl 4-(3-(dimethylamino)acryloyl)benzoate

Structure

(E)-methyl 4-(3-(dimethylamino)acryloyl)benzoate
Name: (E)-methyl 4-(3-(dimethylamino)acryloyl)benzoate
Synonyms:
General Information
Product Number: 114431720
CAS Registry Number: 114431-72-0
Name:
        Benzoic acid, 4-​[(2E)​-​3-​(dimethylamino)​-​1-​oxo-​2-​propen-​1-​yl]​-​, methyl ester
        Benzoic acid, 4-​[(2E)​-​3-​(dimethylamino)​-​1-​oxo-​2-​propenyl]​-​, methyl ester (9CI); Benzoic acid, 4-​[3-​(dimethylamino)​-​1-​oxo-​2-​propenyl]​-​, methyl ester, (E)​- 
 
Chemical Formula: C13H15NO3
Exact Mass: 233.11
Molecular Weight: 233.26
m/z: 233.11 (100.0%), 234.11 (14.3%), 235.11 (1.6%)
Elemental Analysis: C, 66.94; H, 6.48; N, 6.00; O, 20.58
 
InChI: InChI=1S/C13H15NO3/c1-14(2)9-8-12(15)10-4-6-11(7-5-10)13(16)17-3/h4-9H,1-3H3
InChIKey: LRDCVLADWWVIHL-UHFFFAOYSA-N
Canonical SMILES : CN(C)C=CC(=O)C1=CC=C(C=C1)C(=O)OC

Specification

98%

References

PCT Int. Appl. (2014), WO 2014011429 A1 20140116.

PCT Int. Appl. (2013), WO 2013009791 A1 20130117.

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