101564-41-4
2-(1,3-DICHLORO-2-HYDROXY-1,1,3,3-TETRAFLUORO-2-PROPYL)CYCLOHEXANONE THIOSEMICARBAZONE
Name2-(1,3-DICHLORO-2-HYDROXY-1,1,3,3-TETRAFLUORO-2-PROPYL)CYCLOHEXANONE THIOSEMICARBAZONE
FormulaC10 H13 Cl2 F4 N3 O S
1Identification
【Name】
2-(1,3-DICHLORO-2-HYDROXY-1,1,3,3-TETRAFLUORO-2-PROPYL)CYCLOHEXANONE THIOSEMICARBAZONE
【CAS】
【MDL】
MFCD01735093
【English Synonyms】
【Formula】
C10 H13 Cl2 F4 N3 O S
【MolWeight】
370.197
【Inchi】
InChI=1S/C10H13Cl2F4N3OS/c11-9(13,14)8(20,10(12,15)16)5-3-1-2-4-6(5)18-19-7(17)21/h5,20H,1-4H2,(H3,17,19,21)/b18-6+
【InChIKey】
InChIKey=AWCNYHYGKNOLOT-NGYBGAFCSA-N
【SMILES】
C1CC/C(=N\NC(=S)N)/C(C1)C(C(F)(F)Cl)(C(F)(F)Cl)O
【MOL File】
2-(1,3-DICHLORO-2-HY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(1,3-DICHLORO-2-HYDROXY-1,1,3,3-TETRAFLUORO-2-PROPYL)CYCLOHEXANONE THIOSEMICARBAZONE.cml