5702-69-2
1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOLE-3-THIONE
Name1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOLE-3-THIONE
1Identification
【Name】
1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOLE-3-THIONE
【CAS】
【MDL】
MFCD00462164
【English Synonyms】
【Formula】
C11 H12 N2 S
【MolWeight】
204.296
【Inchi】
InChI=1S/C11H12N2S/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3
【InChIKey】
InChIKey=BKHQZVDOSQVERW-UHFFFAOYSA-N
【SMILES】
Cc1cc(=S)n(n1C)c2ccccc2
【MOL File】
1,2-DIHYDRO-1,5-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOLE-3-THIONE.cml