502718-99-2
4-((4-CHLOROBENZYL)OXY)-3-METHOXYBENZALDEHYDE N-ETHYLTHIOSEMICARBAZONE
Name4-((4-CHLOROBENZYL)OXY)-3-METHOXYBENZALDEHYDE N-ETHYLTHIOSEMICARBAZONE
FormulaC18 H20 Cl N3 O2 S
1Identification
【Name】
4-((4-CHLOROBENZYL)OXY)-3-METHOXYBENZALDEHYDE N-ETHYLTHIOSEMICARBAZONE
【CAS】
【MDL】
MFCD04506106
【English Synonyms】
【Formula】
C18 H20 Cl N3 O2 S
【MolWeight】
377.894
【Inchi】
InChI=1S/C18H20ClN3O2S/c1-3-20-18(25)22-21-11-14-6-9-16(17(10-14)23-2)24-12-13-4-7-15(19)8-5-13/h4-11H,3,12H2,1-2H3,(H2,20,22,25)/b21-11+
【InChIKey】
InChIKey=BDFYTTLGSYXBEF-SRZZPIQSSA-N
【SMILES】
CCNC(=S)N/N=C/c1ccc(c(c1)OC)OCc2ccc(cc2)Cl
【MOL File】
4-((4-CHLOROBENZYL)O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-((4-CHLOROBENZYL)OXY)-3-METHOXYBENZALDEHYDE N-ETHYLTHIOSEMICARBAZONE.cml