641615-34-1
(E)-3-(DIMETHYLAMINO)-1-(PYRIMIDIN-5-YL)PROP-2-EN-1-ONE
Name
(E)-3-(DIMETHYLAMINO)-1-(PYRIMIDIN-5-YL)PROP-2-EN-1-ONE
Formula
C9 H11 N3 O
MolWeight
177.206
1Identification
【Name】
(E)-3-(DIMETHYLAMINO)-1-(PYRIMIDIN-5-YL)PROP-2-EN-1-ONE
【CAS】
【MDL】
MFCD09836136
【English Synonyms】
【Formula】
C9 H11 N3 O
【MolWeight】
177.206
【Inchi】
InChI=1S/C9H11N3O/c1-12(2)4-3-9(13)8-5-10-7-11-6-8/h3-7H,1-2H3/b4-3+
【InChIKey】
InChIKey=GNNGOBBGXHJRBH-ONEGZZNKSA-N
【SMILES】
CN(C)/C=C/C(=O)c1cncnc1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(E)-3-(DIMETHYLAMINO)-1-(PYRIMIDIN-5-YL)PROP-2-EN-1-ONE.cml
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