51618-45-2
1-METHYL-5-(4-METHYLPHENYL)SULFONYLSULFANYL-TETRAZOLE
Name1-METHYL-5-(4-METHYLPHENYL)SULFONYLSULFANYL-TETRAZOLE
1Identification
【Name】
1-METHYL-5-(4-METHYLPHENYL)SULFONYLSULFANYL-TETRAZOLE
【CAS】
【MDL】
MFCD18969793
【English Synonyms】
【Formula】
C9 H10 N4 O2 S2
【MolWeight】
270.336
【Inchi】
InChI=1S/C9H10N4O2S2/c1-7-3-5-8(6-4-7)17(14,15)16-9-10-11-12-13(9)2/h3-6H,1-2H3
【InChIKey】
InChIKey=HKWRBJZYIKUKHX-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)Sc2nnnn2C
【MOL File】
1-METHYL-5-(4-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-5-(4-METHYLPHENYL)SULFONYLSULFANYL-TETRAZOLE.cml