175854-39-4
| Name | 1,4,7-tris-Boc-1,4,7,10-tetraaza-cyclododecane |
| CAS | 175854-39-4 |
| Molecular Formula | C23H44N4O6 |
| MDL Number | MFCD09953471 |
| Molecular Weight | 472.63 |
| MOL File | 175854-39-4.mol |
Chemical Properties
| Melting point | 72-73℃ |
| Boiling point | 542.8±35.0 °C(Predicted) |
| density | 1.065 |
| storage temp. | 2-8°C |
| form | powder |
| pka | 9.52±0.20(Predicted) |
| Sensitive | Hygroscopic |
| InChI | InChI=1S/C23H44N4O6/c1-21(2,3)31-18(28)25-12-10-24-11-13-26(19(29)32-22(4,5)6)15-17-27(16-14-25)20(30)33-23(7,8)9/h24H,10-17H2,1-9H3 |
| InChIKey | ZXASHTYJQJMCQR-UHFFFAOYSA-N |
| SMILES | N1(C(OC(C)(C)C)=O)CCNCCN(C(OC(C)(C)C)=O)CCN(C(OC(C)(C)C)=O)CC1 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
