Cas no 114466-04-5 (α-Cyclodextrin, compd. with 2-pentanol (1:1))

α-Cyclodextrin, compd. with 2-pentanol (1:1) structure
114466-04-5 structure
Product Name:α-Cyclodextrin, compd. with 2-pentanol (1:1)
CAS No:114466-04-5
MF:C41H72O31
MW:1060.9917974472
CID:2877914
Update Time:2023-04-05

α-Cyclodextrin, compd. with 2-pentanol (1:1) Chemical and Physical Properties

Names and Identifiers

    • α-Cyclodextrin, compd. with 2-pentanol (1:1)
    • Inchi: 1S/C36H60O30.C5H12O/c37-1-7-25-13(43)19(49)31(55-7)62-26-8(2-38)57-33(21(51)15(26)45)64-28-10(4-40)59-35(23(53)17(28)47)66-30-12(6-42)60-36(24(54)18(30)48)65-29-11(5-41)58-34(22(52)16(29)46)63-27-9(3-39)56-32(61-25)20(50)14(27)44;1-3-4-5(2)6/h7-54H,1-6H2;5-6H,3-4H2,1-2H3/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-;/m1./s1
    • InChI Key: VGBLSQGTUUKRDW-HAPKRNSXSA-N
    • SMILES: C(CC)C(O)C.C([C@H]1O[C@]2([H])O[C@@]3([H])[C@@H]([C@@H](O)[C@@]([H])(O[C@@]4([H])[C@@H]([C@@H](O)[C@@]([H])(O[C@]5([H])[C@@H](CO)O[C@@]([H])([C@@H]([C@H]5O)O)O[C@]5([H])[C@@H](CO)O[C@@]([H])([C@@H]([C@H]5O)O)O[C@]5([H])[C@@H](CO)O[C@@]([H])([C@@H]([C@H]5O)O)O[C@@]1([H])[C@@H]([C@H]2O)O)O[C@@H]4CO)O)O[C@@H]3CO)O)O
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