N4-Benzoylcytidine
- Product NameN4-Benzoylcytidine
- CAS13089-48-0
- MFC16H17N3O6
- MW347.32
- EINECS603-444-9
- MOL File13089-48-0.mol
Chemical Properties
| Melting point | 230-234 °C (dec.)(lit.) |
| Density | 1.59±0.1 g/cm3(Predicted) |
| refractive index | 46 ° (C=1, DMSO) |
| storage temp. | 2-8°C |
| solubility | Soluble in 1N NaOH at 10mg/ml. Also soluble in methanol or DMSO |
| form | Crystalline Powder |
| pka | 8.61±0.20(Predicted) |
| color | White to Off-white |
| optical activity | [α]27/D +55°, c = 0.1 in methanol |
| InChI | 1S/C16H17N3O6/c20-8-10-12(21)13(22)15(25-10)19-7-6-11(18-16(19)24)17-14(23)9-4-2-1-3-5-9/h1-7,10,12-13,15,20-22H,8H2,(H,17,18,23,24)/t10-,12-,13-,15-/m1/s1 |
| InChIKey | BNXBRFDWSPXODM-BPGGGUHBSA-N |
| SMILES | OC[C@H]1O[C@@H](N2C=CC(NC(=O)C3=CC=CC=C3)=NC2=O)[C@H](O)[C@@H]1O |
| CAS DataBase Reference | 13089-48-0(CAS DataBase Reference) |
Safety Information
| Safety Statements | 24/25 |
| WGK Germany | 3 |
| HS Code | 29349990 |
| Storage Class | 11 - Combustible Solids |
