51308-58-8
(4-(1,1-DIMETHYLETHYL)PHENYL)METHYL HEXYL-3-PYRIDINYLCARBONIMIDODITHIOATE
Name(4-(1,1-DIMETHYLETHYL)PHENYL)METHYL HEXYL-3-PYRIDINYLCARBONIMIDODITHIOATE
1Identification
【Name】
(4-(1,1-DIMETHYLETHYL)PHENYL)METHYL HEXYL-3-PYRIDINYLCARBONIMIDODITHIOATE
【CAS】
【MDL】
MFCD01937737
【English Synonyms】
【Formula】
C23 H32 N2 S2
【MolWeight】
400.652
【Inchi】
InChI=1S/C23H32N2S2/c1-5-6-7-8-16-26-22(25-21-10-9-15-24-17-21)27-18-19-11-13-20(14-12-19)23(2,3)4/h9-15,17H,5-8,16,18H2,1-4H3/b25-22+
【InChIKey】
InChIKey=GBXKJAOSGYVSQH-YYDJUVGSSA-N
【SMILES】
CCCCCCS/C(=N\c1cccnc1)/SCc2ccc(cc2)C(C)(C)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(4-(1,1-DIMETHYLETHYL)PHENYL)METHYL HEXYL-3-PYRIDINYLCARBONIMIDODITHIOATE.cml