769146-45-4
5-BROMO-2-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
Name5-BROMO-2-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
1Identification
【Name】
5-BROMO-2-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE
【CAS】
【MDL】
MFCD05721095
【English Synonyms】
【Formula】
C16 H16 Br N3 O S
【MolWeight】
378.292
【Inchi】
InChI=1S/C16H16BrN3OS/c1-11-4-3-5-14(8-11)19-16(22)20-18-10-12-9-13(17)6-7-15(12)21-2/h3-10H,1-2H3,(H2,19,20,22)/b18-10+
【InChIKey】
InChIKey=VICUTUMEVWMFJC-VCHYOVAHSA-N
【SMILES】
Cc1cccc(c1)NC(=S)N/N=C/c2cc(ccc2OC)Br
【MOL File】
5-BROMO-2-METHOXYBEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-BROMO-2-METHOXYBENZALDEHYDE N-(3-METHYLPHENYL)THIOSEMICARBAZONE.cml