110623-31-9
2,4-DIHYDRO-5-(2,6-DICHLOROPHENYL)-2,4-DIMETHYL-3H-1,2,4-TRIAZOLE-3-THIONE
Name2,4-DIHYDRO-5-(2,6-DICHLOROPHENYL)-2,4-DIMETHYL-3H-1,2,4-TRIAZOLE-3-THIONE
pro_formulaC10 H9 Cl2 N3 S
1Identification
【Name】
2,4-DIHYDRO-5-(2,6-DICHLOROPHENYL)-2,4-DIMETHYL-3H-1,2,4-TRIAZOLE-3-THIONE
【CAS】
【MDL】
MFCD01678500
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C10 H9 Cl2 N3 S
【pro_molWeight】
274.174
【Inchi】
InChI=1S/C10H9Cl2N3S/c1-14-9(13-15(2)10(14)16)8-6(11)4-3-5-7(8)12/h3-5H,1-2H3
【InChIKey】
InChIKey=PXPADZJHWYTOND-UHFFFAOYSA-N
【SMILES】
Cn1c(nn(c1=S)C)c2c(cccc2Cl)Cl
【MOL File】
2,4-DIHYDRO-5-(2,6-D….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2,4-DIHYDRO-5-(2,6-DICHLOROPHENYL)-2,4-DIMETHYL-3H-1,2,4-TRIAZOLE-3-THIONE.cml