96160-01-9
4,5-DIHYDRO-3-METHYL-2-(4-METHYLPHENYL)THIAZOLIUM IODIDE
Name4,5-DIHYDRO-3-METHYL-2-(4-METHYLPHENYL)THIAZOLIUM IODIDE
1Identification
【Name】
4,5-DIHYDRO-3-METHYL-2-(4-METHYLPHENYL)THIAZOLIUM IODIDE
【CAS】
【MDL】
MFCD01680776
【English Synonyms】
【Formula】
C11 H14 N S . I
【MolWeight】
319.205
【Inchi】
InChI=1S/C11H14NS.HI/c1-9-3-5-10(6-4-9)11-12(2)7-8-13-11;/h3-6H,7-8H2,1-2H3;1H/q+1;/p-1
【InChIKey】
InChIKey=MSLIIMQZEBURFZ-UHFFFAOYSA-M
【SMILES】
Cc1ccc(cc1)C2=[N+](CCS2)C.[I-]
【MOL File】
4,5-DIHYDRO-3-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,5-DIHYDRO-3-METHYL-2-(4-METHYLPHENYL)THIAZOLIUM IODIDE.cml