424-16-8
1H,1H,7H-DODECAFLUOROHEPTYL P-TOLUENESULFONATE
Name1H,1H,7H-DODECAFLUOROHEPTYL P-TOLUENESULFONATE
1Identification
【Name】
1H,1H,7H-DODECAFLUOROHEPTYL P-TOLUENESULFONATE
【CAS】
【MDL】
MFCD00490197
【English Synonyms】
2,2,3,3,4,4,5,5,6,6,7,7-DODECAFLUOROHEPTYL4-METHYLBENZENE-1-SULFONATE
【Formula】
C14 H10 F12 O3 S
【MolWeight】
486.272
【Inchi】
InChI=1S/C14H10F12O3S/c1-7-2-4-8(5-3-7)30(27,28)29-6-10(17,18)12(21,22)14(25,26)13(23,24)11(19,20)9(15)16/h2-5,9H,6H2,1H3
【InChIKey】
InChIKey=OXJVZWUUXGCJLH-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
【MOL File】
1H,1H,7H-DODECAFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H,1H,7H-DODECAFLUOROHEPTYL P-TOLUENESULFONATE.cml