56916-60-0
4-CYANOETHYLSULFONYL-2,3,5,6-TETRACHLOROBENZONITRILE
Name4-CYANOETHYLSULFONYL-2,3,5,6-TETRACHLOROBENZONITRILE
FormulaC10 H4 Cl4 N2 O2 S
1Identification
【Name】
4-CYANOETHYLSULFONYL-2,3,5,6-TETRACHLOROBENZONITRILE
【CAS】
【MDL】
MFCD01662152
【English Synonyms】
【Formula】
C10 H4 Cl4 N2 O2 S
【MolWeight】
358.032
【Inchi】
InChI=1S/C10H4Cl4N2O2S/c11-6-5(4-16)7(12)9(14)10(8(6)13)19(17,18)3-1-2-15/h1,3H2
【InChIKey】
InChIKey=JNWPMAKJHMMAIG-UHFFFAOYSA-N
【SMILES】
C(CS(=O)(=O)c1c(c(c(c(c1Cl)Cl)C#N)Cl)Cl)C#N
【MOL File】
4-CYANOETHYLSULFONYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CYANOETHYLSULFONYL-2,3,5,6-TETRACHLOROBENZONITRILE.cml