494798-73-1
4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-十七氟十一烷氧基)苯甲醛
Name4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-十七氟十一烷氧基)苯甲醛
pro_formulaC18 H11 F17 O2
1Identification
【Name】
4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-十七氟十一烷氧基)苯甲醛
【CAS】
【MDL】
MFCD03788351
【中文同义词】
4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-十七氟十一烷氧基)苯甲醛
【EnglishSynonyms】
4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-HEPTADECAFLUOROUNDECYLOXY) BENZALDEHYDE
【pro_formula】
C18 H11 F17 O2
【pro_molWeight】
582.249
【Inchi】
InChI=1S/C18H11F17O2/c19-11(20,6-1-7-37-10-4-2-9(8-36)3-5-10)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35/h2-5,8H,1,6-7H2
【InChIKey】
InChIKey=KOLANEVLEDPTQG-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C=O)OCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
【MOL File】
4-(4,4,5,5,6,6,7,7,8….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:10.0
Bulk/Fine:F
3MaterialMSDS
【secure_risk_stmt】
【secure_wgk_germany】
3
4CMLFile
4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-十七氟十一烷氧基)苯甲醛.cml