2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine (CAS 161599-46-8) — formula C13H16FN3O6, molecular weight 329.28; category organic chemicals.
| CAS Number | 161599-46-8 |
|---|---|
| Molecular Formula | C13H16FN3O6 |
| Molecular Weight | 329.28 |
| LogP | -0.7 |
| Applications | Use Classification: Pharmaceuticals |
| Category | Organic Chemicals |
Documented applications: Use Classification: Pharmaceuticals.
2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine is a carbon-based organic compound with CAS registry number 161599-46-8 and molecular formula C13H16FN3O6 (molecular weight 329.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 161599-46-8
Its molecular formula C13H16FN3O6 comprises 13 C, 16 H, 1 F, 3 N, 6 O atoms.
Also known as: 2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine · 2',3'-二-O-乙酰基-5'-脱氧-5-氟胞苷
Category: organic chemicals
The CAS registry number of 2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine is 161599-46-8.
Molecular formula C13H16FN3O6, molecular weight 329.28.
It is also registered under: 2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine, 2',3'-二-O-乙酰基-5'-脱氧-5-氟胞苷.
Recorded applications: Use Classification: Pharmaceuticals.
Category: Organic Chemicals.
Independent reference data for 2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine (CAS 161599-46-8), compiled from public chemistry databases.
| CAS Registry Number | 161599-46-8 |
|---|---|
| PubChem CID | 11809635 |
| Molecular formula | C13H16FN3O6 |
| IUPAC name | [(2R,3R,4R,5R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate |
| UNII (FDA) | Q6KTK8KQR2 |
| Molecular Weight | 329.28 |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 329.10231340 |
| Monoisotopic Mass | 329.10231340 |
| Topological Polar Surface Area | 121 |
| Heavy Atom Count | 23 |
161599-46-8; 5'-Deoxy-2',3'-di-O-acetyl-5-fluorocytidine; 2',3'-DI-O-ACETYL-5'-DEOXY-5-FLUOROCYTIDINE; Cytidine, 5'-deoxy-5-fluoro-, 2',3'-diacetate; UNII-Q6KTK8KQR2; Q6KTK8KQR2; DTXSID40167207; EC 605-260-4; CHEBI:83538; 2`,3`-di-O-acetyl-5`-deoxy-5-fluorocytidin; RefChem:80022; DTXCID0089698; 605-260-4; Capecitabine EP Impurity C; C13H16FN3O6; 2,3-Di-O-Acetyl-5-Deoxy-5-Fuluro-D-Cytidine
| Reported hazard statements | H315 (28.6%), H319 (28.6%), H341 (71.4%), H350 (85.7%), H351 (14.3%), H360 (100%), H411 (14.3%) |
|---|
H315 (28.6%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (28.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
2',3'-Di-O-Acetyl-5'-Deoxy-5-Fluorocytidine · CAS 161599-46-8 · C13H16FN3O6. UNII Q6KTK8KQR2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.