765281-64-9
3,4,5-TRIMETHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
Name3,4,5-TRIMETHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
1Identification
【Name】
3,4,5-TRIMETHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
【CAS】
【MDL】
MFCD00584873
【English Synonyms】
【Formula】
C18 H21 N3 O3 S
【MolWeight】
359.448
【Inchi】
InChI=1S/C18H21N3O3S/c1-12-6-5-7-14(8-12)20-18(25)21-19-11-13-9-15(22-2)17(24-4)16(10-13)23-3/h5-11H,1-4H3,(H2,20,21,25)/b19-11+
【InChIKey】
InChIKey=IUOWECZPBYDSNS-YBFXNURJSA-N
【SMILES】
Cc1cccc(c1)NC(=S)N/N=C/c2cc(c(c(c2)OC)OC)OC
【MOL File】
3,4,5-TRIMETHOXYBENZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4,5-TRIMETHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE.cml