1-(4-ISOTHIOCYANATOBENZYL)ETHYLENEDIAMINE-N,N,N',N'-TETRAACETIC ACID
- Product Name1-(4-ISOTHIOCYANATOBENZYL)ETHYLENEDIAMINE-N,N,N',N'-TETRAACETIC ACID
- CAS105394-74-9
- CBNumberCB8670218
- MFC18H21N3O8S
- MW439.44
- MDL NumberMFCD00236411
- MOL File105394-74-9.mol
Chemical Properties
| Boiling point | 765.3±60.0 °C(Predicted) |
| Density | 1.43±0.1 g/cm3(Predicted) |
| storage temp. | −20°C |
| pka | 1.78±0.10(Predicted) |
| BRN | 8363400 |
| InChI | 1S/C18H21N3O8S/c22-15(23)7-20(8-16(24)25)6-14(21(9-17(26)27)10-18(28)29)5-12-1-3-13(4-2-12)19-11-30/h1-4,14H,5-10H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29) |
| InChIKey | VHMWJVAFPCGUTJ-UHFFFAOYSA-N |
| SMILES | OC(=O)CN(CC(Cc1ccc(cc1)N=C=S)N(CC(O)=O)CC(O)=O)CC(O)=O |
| UNSPSC Code | 12352106 |
| NACRES | NA.25 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| F | 10 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |