899359-40-1
4-[4-(1,1-DIMETHYLETHYL)PHENYL]-2(3H)-THIAZOLONE HYDRAZONE
Name4-[4-(1,1-DIMETHYLETHYL)PHENYL]-2(3H)-THIAZOLONE HYDRAZONE
1Identification
【Name】
4-[4-(1,1-DIMETHYLETHYL)PHENYL]-2(3H)-THIAZOLONE HYDRAZONE
【CAS】
【MDL】
MFCD11220635
【English Synonyms】
【Formula】
C13 H17 N3 S
【MolWeight】
247.364
【Inchi】
InChI=1S/C13H17N3S/c1-13(2,3)10-6-4-9(5-7-10)11-8-17-12(15-11)16-14/h4-8H,14H2,1-3H3,(H,15,16)
【InChIKey】
InChIKey=QBOMUSYYDHRFQO-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1ccc(cc1)c2cs/c(=N\N)/[nH]2
【MOL File】
4-[4-(1,1-DIMETHYLET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[4-(1,1-DIMETHYLETHYL)PHENYL]-2(3H)-THIAZOLONE HYDRAZONE.cml