257632-84-1
2-(1,1-DIMETHYLETHYL)-5-METHYL-BENZOTHIAZOLE
Name2-(1,1-DIMETHYLETHYL)-5-METHYL-BENZOTHIAZOLE
1Identification
【Name】
2-(1,1-DIMETHYLETHYL)-5-METHYL-BENZOTHIAZOLE
【CAS】
【MDL】
MFCD11217413
【English Synonyms】
【Formula】
C12 H15 N S
【MolWeight】
205.324
【Inchi】
InChI=1S/C12H15NS/c1-8-5-6-10-9(7-8)13-11(14-10)12(2,3)4/h5-7H,1-4H3
【InChIKey】
InChIKey=KASMIUAEGYEKBK-UHFFFAOYSA-N
【SMILES】
Cc1ccc2c(c1)nc(s2)C(C)(C)C
【MOL File】
2-(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
2-(1,1-DIMETHYLETHYL)-5-METHYL-BENZOTHIAZOLE.cml