Synonyms
(1R,2R)-(-)-1,2-CYCLOHEXANE DIAMINO-N,N'-BIS(3,5-DI-TERT-BUTYLSALICYLIDENE); 2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one; ANW-54576; (1R,2R)-(-)-1,2-Cyclohexanediamino-N,N'-bis(3,5-di-t-butylsalicylidene), (R,R)-Jacobsen Ligand; MFCD00191800; 616R409; AK-58435; AC1OGTF1; (R,R)-Jacobsen inverted exclamation mark s ligand; (R,R)-1,2-bis(3,5-di-tert-butylsalicylidenamino)cyclohexane;
IUPAC Name
2,4-ditert-butyl-6-[[(1R,2R)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;
Molecular Weight
546.84g/mol
Molecular Formula
C36H54N2O2;
Canonical SMILES
CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C;
InChI
InChI=1S/C36H54N2O2/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12/h17-22,29-30,39-40H,13-16H2,1-12H3/t29-,30-/m1/s1;
InChI Key
FYNXDGNCEBQLGC-LOYHVIPDSA-N;
Complexity
793
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
546.419g/mol
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
40
Monoisotopic Mass
546.419g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
65.2A^2
