654666-65-6
1,2,4,5,6,7-HEXAHYDRO-3H-PYRAZOLO[3,4-C]PYRIDIN-3-ONE
Name1,2,4,5,6,7-HEXAHYDRO-3H-PYRAZOLO[3,4-C]PYRIDIN-3-ONE
1Identification
【Name】
1,2,4,5,6,7-HEXAHYDRO-3H-PYRAZOLO[3,4-C]PYRIDIN-3-ONE
【CAS】
【MDL】
MFCD13178728
【English Synonyms】
【Formula】
C6 H9 N3 O
【MolWeight】
139.157
【Inchi】
InChI=1S/C6H9N3O/c10-6-4-1-2-7-3-5(4)8-9-6/h7H,1-3H2,(H2,8,9,10)
【InChIKey】
InChIKey=UPMMUUFLHUEUKP-UHFFFAOYSA-N
【SMILES】
C1CNCc2c1c(=O)[nH][nH]2
【MOL File】
1,2,4,5,6,7-HEXAHYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:-2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,4,5,6,7-HEXAHYDRO-3H-PYRAZOLO[3,4-C]PYRIDIN-3-ONE.cml