858220-74-3
1,8-DIHYDRO-IMIDAZO[4,5-G]INDAZOL-3(2H)-ONE
Name1,8-DIHYDRO-IMIDAZO[4,5-G]INDAZOL-3(2H)-ONE
1Identification
【Name】
1,8-DIHYDRO-IMIDAZO[4,5-G]INDAZOL-3(2H)-ONE
【CAS】
【MDL】
MFCD16878321
【English Synonyms】
【Formula】
C8 H6 N4 O
【MolWeight】
174.162
【Inchi】
InChI=1S/C8H6N4O/c13-8-4-1-2-5-7(10-3-9-5)6(4)11-12-8/h1-3H,(H,9,10)(H2,11,12,13)
【InChIKey】
InChIKey=MTWLSKNUMCDJPJ-UHFFFAOYSA-N
【SMILES】
c1cc2c(c3c1c(=O)[nH][nH]3)[nH]cn2
【MOL File】
1,8-DIHYDRO-IMIDAZO[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,8-DIHYDRO-IMIDAZO[4,5-G]INDAZOL-3(2H)-ONE.cml