767289-67-8
4-((4-CHLOROBENZYL)OXY)BENZALDEHYDE N-CYCLOHEXYLTHIOSEMICARBAZONE
Name4-((4-CHLOROBENZYL)OXY)BENZALDEHYDE N-CYCLOHEXYLTHIOSEMICARBAZONE
1Identification
【Name】
4-((4-CHLOROBENZYL)OXY)BENZALDEHYDE N-CYCLOHEXYLTHIOSEMICARBAZONE
【CAS】
【MDL】
MFCD06199370
【English Synonyms】
【Formula】
C21 H24 Cl N3 O S
【MolWeight】
401.96
【Inchi】
InChI=1S/C21H24ClN3OS/c22-18-10-6-17(7-11-18)15-26-20-12-8-16(9-13-20)14-23-25-21(27)24-19-4-2-1-3-5-19/h6-14,19H,1-5,15H2,(H2,24,25,27)/b23-14+
【InChIKey】
InChIKey=KZGHEYJQSMLGBW-OEAKJJBVSA-N
【SMILES】
c1cc(ccc1COc2ccc(cc2)/C=N/NC(=S)NC3CCCCC3)Cl
【MOL File】
4-((4-CHLOROBENZYL)O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-((4-CHLOROBENZYL)OXY)BENZALDEHYDE N-CYCLOHEXYLTHIOSEMICARBAZONE.cml