| Catalog Number |
ACM135616363 |
| CAS |
135616-36-3 |
| Structure |
 |
| Description |
(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine, also known as (+)-DTBS, is an organosulfur compound used in a variety of scientific research applications. It is a colorless solid that is soluble in organic solvents and can be synthesized using a number of methods. (+)-DTBS is used in the synthesis of a variety of compounds, including pharmaceuticals, agrochemicals, and materials. It has been studied for its potential role in the biochemical and physiological effects of certain drugs, as well as its advantages and limitations for laboratory experiments. |
| Synonyms |
2,2'-[(1S,2S)-1,2-cyclohexanediylbis[(E)-nitrilomethylidyne]]bis[4,6-bis(1,1-dimethylethylphenol; [1S-[1α(E),2β(E)]]-2,2'-[1,2-cyclohexanediylbis(nitrilomethylidyne)]bis[4,6-bis(1,1-dimethylethyl)phenol; |
| IUPAC Name |
2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol |
| Molecular Weight |
546.83 g/mol |
| Molecular Formula |
C36H54N2O2 |
| Canonical SMILES |
CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C=NC2CCCCC2N=CC3=C(C(=CC(=C3)C(C)(C)C)C(C)(C)C)O |
| 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-/m0/s1 |
| InChI Key |
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-/m0/s1 |
| Boiling Point |
646.3 °C at 760 mmHg |
| Melting Point |
203-206 °C-lit. |
| Flash Point |
115.2ºC |
| Purity |
95% |
| Density |
1.03g/cm³ |
| Appearance |
Powder |
| Application |
(+)-DTBS has a number of scientific research applications. It is used in the synthesis of a variety of compounds, including pharmaceuticals, agrochemicals, and materials. It is also used as a catalyst for the synthesis of polymers, and as a reagent for the synthesis of polycyclic aromatic hydrocarbons. In addition, (+)-DTBS is used as a ligand in coordination chemistry, and as a component of a variety of analytical techniques, such as HPLC and GC-MS. |
| EC Number |
603-924-8 |
| Exact Mass |
546.41900 |
| Isomeric SMILES |
CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C=N[C@H]2CCCC[C@@H]2N=CC3=C(C(=CC(=C3)C(C)(C)C)C(C)(C)C)O |
| Properties |
The biochemical and physiological effects of (+)-DTBS are not yet fully understood. However, it has been shown to have anti-inflammatory and anti-oxidant properties. Additionally, (+)-DTBS has been shown to inhibit the growth of certain cancer cells, and to exhibit protective effects against oxidative stress. |
