2-Chloroadenosine hemidydrate
- Product Name2-Chloroadenosine hemidydrate
- CAS81012-94-4
- MFC10H14ClN5O5
- MW319.7
- EINECS630-491-2
- MOL File81012-94-4.mol
Chemical Properties
| Melting point | 160 °C (dec.)(lit.) |
| storage temp. | Keep in dark place,Inert atmosphere,2-8°C |
| form | powder |
| InChI | 1S/2C10H12ClN5O4.H2O/c2*11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9;/h2*2-3,5-6,9,17-19H,1H2,(H2,12,14,15);1H2/t2*3-,5-,6-,9-;/m11./s1 |
| InChIKey | WRURCFOLSGPTMO-IZGCVNAISA-N |
| SMILES | O[C@H]1[C@@H](O)[C@H](N(C=N2)C3=C2C(N)=NC(Cl)=N3)O[C@@H]1CO.O[C@H]4[C@@H](O)[C@H](N(C=N5)C6=C5C(N)=NC(Cl)=N6)O[C@@H]4CO.O |
| CAS DataBase Reference | 81012-94-4 |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22 |
| Safety Statements | 36 |
| WGK Germany | 3 |
| Hazard Note | Harmful |
| HS Code | 2934999090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
