1247348-29-3
5-(1,1-DIMETHYLETHYL)BENZOTHIAZOLE
Name5-(1,1-DIMETHYLETHYL)BENZOTHIAZOLE
1Identification
【Name】
5-(1,1-DIMETHYLETHYL)BENZOTHIAZOLE
【CAS】
【MDL】
MFCD17014588
【English Synonyms】
【Formula】
C11 H13 N S
【MolWeight】
191.297
【Inchi】
InChI=1S/C11H13NS/c1-11(2,3)8-4-5-10-9(6-8)12-7-13-10/h4-7H,1-3H3
【InChIKey】
InChIKey=JYMIUYXSNLCPAD-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1ccc2c(c1)ncs2
【MOL File】
5-(1,1-DIMETHYLETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(1,1-DIMETHYLETHYL)BENZOTHIAZOLE.cml