97604-06-3
2-(PYRIDIN-3-YL)-3,4-DIHYDROPYRIMIDIN-4-ONE
Name2-(PYRIDIN-3-YL)-3,4-DIHYDROPYRIMIDIN-4-ONE
1Identification
【Name】
2-(PYRIDIN-3-YL)-3,4-DIHYDROPYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD12107647
【English Synonyms】
【Formula】
C9 H7 N3 O
【MolWeight】
173.174
【Inchi】
InChI=1S/C9H7N3O/c13-8-3-5-11-9(12-8)7-2-1-4-10-6-7/h1-6H,(H,11,12,13)
【InChIKey】
InChIKey=RBYRTULDUOUZQC-UHFFFAOYSA-N
【SMILES】
c1cc(cnc1)c2[nH]c(=O)ccn2
【MOL File】
2-(PYRIDIN-3-YL)-3,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(PYRIDIN-3-YL)-3,4-DIHYDROPYRIMIDIN-4-ONE.cml