TRI-T-BUTYL 1 4 7 10-TETRAAZACYCLODODECA
- Product NameTRI-T-BUTYL 1 4 7 10-TETRAAZACYCLODODECA
- CAS122555-91-3
- MFC26H50N4O6
- MW514.7
- EINECS635-018-3
- MOL File122555-91-3.mol
Chemical Properties
Melting point | 181-183℃ |
Boiling point | 561.6±50.0 °C(Predicted) |
Density | 1.022 |
storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
solubility | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
form | Low-Melting Solid |
pka | 9.57±0.20(Predicted) |
color | White to Off-White |
Sensitive | Hygroscopic |
InChI | InChI=1S/C26H50N4O6/c1-24(2,3)34-21(31)18-28-12-10-27-11-13-29(19-22(32)35-25(4,5)6)15-17-30(16-14-28)20-23(33)36-26(7,8)9/h27H,10-20H2,1-9H3 |
InChIKey | NMHVTLJFPDOJOD-UHFFFAOYSA-N |
SMILES | N1(CC(OC(C)(C)C)=O)CCNCCN(CC(OC(C)(C)C)=O)CCN(CC(OC(C)(C)C)=O)CC1 |
Safety Information
Hazard Codes | Xi |
Risk Statements | 36/37/38 |
Safety Statements | 26 |
WGK Germany | 3 |
HS Code | 29339900 |