62770-12-1
4-METHYL-5-METHYLSULFANYL-4H-[1,2,4]TRIAZOLE-3-THIOL
Name4-METHYL-5-METHYLSULFANYL-4H-[1,2,4]TRIAZOLE-3-THIOL
1Identification
【Name】
4-METHYL-5-METHYLSULFANYL-4H-[1,2,4]TRIAZOLE-3-THIOL
【CAS】
【MDL】
MFCD00067822
【English Synonyms】
【Formula】
C4 H7 N3 S2
【MolWeight】
161.252
【Inchi】
InChI=1S/C4H7N3S2/c1-7-3(8)5-6-4(7)9-2/h1-2H3,(H,5,8)
【InChIKey】
InChIKey=CYOIASDURSLVSN-UHFFFAOYSA-N
【SMILES】
Cn1c(nnc1SC)S
【MOL File】
4-METHYL-5-METHYLSUL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-METHYL-5-METHYLSULFANYL-4H-[1,2,4]TRIAZOLE-3-THIOL.cml