二辛基癸基ipdi dioctyldecyl IPDI
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iupac名称 IUPAC Name :2-辛基癸基n-[[1 2-octyldecyl N-[[1,3,3-trimethyl-5-(2-octyldecoxycarbonylamino)cyclohexyl]methyl]carbamate
INCHI InChI :INCHI InChI=1/C48H94N2O4/c1-8-12-16-20-24-28-32-42(33-29-25-21-17-13-9-2)38-53-45(51)49-41-48(7)37-44(36-47(5,6)40-48)50-46(52)54-39-43(34-30-26-22-18-14-10-3)35-31-27-23-19-15-11-4/h42-44H,8-41H2,1-7H3,(H,49,51)(H,50,52)
印地 Std.InChI: INCHI InChI=1S/C48H94N2O4/c1-8-12-16-20-24-28-32-42(33-29-25-21-17-13-9-2)38-53-45(51)49-41-48(7)37-44(36-47(5,6)40-48)50-46(52)54-39-43(34-30-26-22-18-14-10-3)35-31-27-23-19-15-11-4/h42-44H,8-41H2,1-7H3,(H,49,51)(H,50,52)
INCHI基 InChIKey :UNPITQLQSYOPNI-UHFFFAOYAV
标准奇奇 Std.InChIKey: UNPITQLQSYOPNI-UHFFFAOYSA-N
微笑 SMILES :ccccccccc cccccccc cc CCcc CCcc CCcc CCC(cccccccc cc CCcc CCcc CCcc CC)coc COC(= o =O)Ncc CC1(cc CC(cc CC(C1)(C)C)数控 NC(= o =O)occ Occ CC(cccccccc cc CCcc CCcc CCcc CC)cccccccc cc CCcc CCcc CCcc CC)C
磨牙 Molar 折射率 Refractivity :231.59 ± 0.5 cm3 (估 est)
Parachor :1919.1 ± 8.0 cm3 (估 est)
折射率 Index of Refraction :1.493 ± 0.05
(估 est)
表面张力 Surface Tension :33.7 ± 7.0 dyne/cm (估 est)
密度 Density :0.95 ± 0.1 g/cm3 (估 est)
极化率 Polarizability :91.80 ± 0.5 10-24cm3 (估 est)