52240-00-3
6-(THIOPHEN-2-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONE
Name6-(THIOPHEN-2-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONE
1Identification
【Name】
6-(THIOPHEN-2-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONE
【CAS】
【MDL】
MFCD00113240
【English Synonyms】
【Formula】
C8 H8 N2 O S
【MolWeight】
180.23
【Inchi】
InChI=1S/C8H8N2OS/c11-8-4-3-6(9-10-8)7-2-1-5-12-7/h1-2,5H,3-4H2,(H,10,11)
【InChIKey】
InChIKey=SLIODHPLYGIMCY-UHFFFAOYSA-N
【SMILES】
c1cc(sc1)C2=NNC(=O)CC2
【MOL File】
6-(THIOPHEN-2-YL)-2,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-(THIOPHEN-2-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONE.cml