3-(Dimethylamino)-1-(2-pyrazinyl)-2-propen-1-one

CAS

111781-53-4

Catalog Number

ACM111781534

Category

Other Products

Molecular Weight

177.21

Molecular Formula

C9H11N3O

MSDS COA Spec Sheet

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Specification

Synonyms

(2E)-3-(dimethylamino)-1-(pyrazin-2-yl)prop-2-en-1-one, 111781-53-4, 3-(Dimethylamino)-1-(pyrazin-2-yl)prop-2-en-1-one, AC1NYBEK, AC1Q3VVG, SureCN4262480, dimethylaminopyrazinylpropenone, MolPort-002-867-061, MolPort-019-747-074, SBB089275, ZINC06176740, AKOS005070361, PB17286, RP10768, AK-56054, FT-0680329, 3-DIMETHYLAMINO-1-PYRAZIN-2-YL-PROPENONE, 3W-0873, I05-1907, (2E)-3-(dimethylamino)-1-pyrazin-2-ylprop-2-en-1-one

IUPAC Name

(E)-3-(dimethylamino)-1-pyrazin-2-ylprop-2-en-1-one

Canonical SMILES

CN(C)C=CC(=O)C1=NC=CN=C1

InChI Key

CLHUZMQFALLXDS-ZZXKWVIFSA-N

Melting Point

131-133ºC

Exact Mass

177.09000

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

22047-25-2
4637-24-5

111781-53-4

Reference: [1]Liu, Yi-Feng; Wang, Cui-Ling; Bai, Ya-Jun; Han, Ning; Jiao, Jun-Ping; Qi, Xiao-Li
[Organic Process Research and Development, 2008, vol. 12, # 3, p. 490 - 495]
[2]Ho, Yuh-Wen; Yao, Chia-Tseng
[Journal of the Chinese Chemical Society, 2003, vol. 50, # 2, p. 283 - 296]
[3]Location in patent: experimental part
RamaRao, R. Janaki; Rao, A.K.S. Bhujanga; Sreenivas; Kumar, B. Suneel; Murthy
[Journal of the Korean Chemical Society, 2011, vol. 55, # 2, p. 243 - 250]
Location in patent: experimental part
Rama Rao, R. Janaki; Rao, A.K.S. Bhujanga; Swapna; Rani, B. Baby; Murthy
[Asian Journal of Chemistry, 2012, vol. 24, # 4, p. 1837 - 1843]
[4]Current Patent Assignee: NIPPON SHINYAKU CO LTD - EP1533304, 2005, A1
Location in patent: Page/Page column 15; 16
[5]Wang, Ning-Yu; Zuo, Wei-Qiong; Xu, Ying; Gao, Chao; Zeng, Xiu-Xiu; Zhang, Li-Dan; You, Xin-Yu; Peng, Cui-Ting; Shen, Yang; Yang, Sheng-Yong; Wei, Yu-Quan; Yu, Luo-Ting
[Bioorganic and Medicinal Chemistry Letters, 2014, vol. 24, # 6, p. 1581 - 1588]