63446-38-8
3-METHYL-1,5,6,7-TETRAHYDROINDAZOL-4-ONE
Name3-METHYL-1,5,6,7-TETRAHYDROINDAZOL-4-ONE
1Identification
【Name】
3-METHYL-1,5,6,7-TETRAHYDROINDAZOL-4-ONE
【CAS】
【MDL】
MFCD00168632
【English Synonyms】
【Formula】
C8 H10 N2 O
【MolWeight】
150.18
【Inchi】
InChI=1S/C8H10N2O/c1-5-8-6(10-9-5)3-2-4-7(8)11/h2-4H2,1H3,(H,9,10)
【InChIKey】
InChIKey=VROXGINCMQLXRS-UHFFFAOYSA-N
【SMILES】
Cc1c2c([nH]n1)CCCC2=O
【MOL File】
3-METHYL-1,5,6,7-TET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3-METHYL-1,5,6,7-TETRAHYDROINDAZOL-4-ONE.cml