767334-15-6
3-(ALLYLOXY)BENZALDEHYDE N-PHENYLTHIOSEMICARBAZONE
Name3-(ALLYLOXY)BENZALDEHYDE N-PHENYLTHIOSEMICARBAZONE
1Identification
【Name】
3-(ALLYLOXY)BENZALDEHYDE N-PHENYLTHIOSEMICARBAZONE
【CAS】
【MDL】
MFCD06199581
【English Synonyms】
【Formula】
C17 H17 N3 O S
【MolWeight】
311.407
【Inchi】
InChI=1S/C17H17N3OS/c1-2-11-21-16-10-6-7-14(12-16)13-18-20-17(22)19-15-8-4-3-5-9-15/h2-10,12-13H,1,11H2,(H2,19,20,22)/b18-13+
【InChIKey】
InChIKey=UPTZNSDUOXALJM-QGOAFFKASA-N
【SMILES】
C=CCOc1cccc(c1)/C=N/NC(=S)Nc2ccccc2
【MOL File】
3-(ALLYLOXY)BENZALDE….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
3-(ALLYLOXY)BENZALDEHYDE N-PHENYLTHIOSEMICARBAZONE.cml