Chemical Component Summary

Name1-(2-[(S)-2,4-Dihydroxybutoxy]ethyl)-12-(5-ethyl-5-hydroxyheptyl)-1,12-dicarba-closo-dodecaborane
FormulaC17 H42 B10 O4
Molecular Weight418.623
TypeNON-POLYMER
Isomeric SMILES[BH]1234[BH]567[BH]189[BH]212[BH]33%10C454([BH]656[BH]433[BH]%1011[BH]353[BH]768C9213CCOC[C@H](CCO)O)CCCCC(CC)(CC)O
InChIInChI=1S/C17H42B10O4/c1-3-15(30,4-2)8-5-6-9-16-18-19(16)21(16)22(16)20(16,18)24(18)17(10-12-31-13-14(29)7-11-28)23(18,19,24)25(17,19,21)27(17,21,22)26(17,20,22)24/h14,18-30H,3-13H2,1-2H3/t14-/m0/s1
InChIKeyCZLKNINFVMBXBM-AWEZNQCLSA-N

Chemical Details

Formal Charge0
Atom Count73
Chiral Atom Count1
Bond Count91
Aromatic Bond Count0