5'-Deoxy-5-fluorocytidine
- CAS No.
- 66335-38-4
- Chemical Name:
- 5'-Deoxy-5-fluorocytidine
- Synonyms
- 5'-DFCR;4-aMino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-Methyltetrahydrofuran-2-yl)-5-fluoropyriMidin-2(1H)-one;5-F-5'-dC;[2H2]-5-DFCR;Capecitabine-1;Capecitabine Imp.A;Deoxy fluorocytidine;Capecitabine USP RC A;Capecitabine USP IMp.A;Capecitabine Impurity 1
- CBNumber:
- CB0258261
- Molecular Formula:
- C9H12FN3O4
- Molecular Weight:
- 245.21
- MDL Number:
- MFCD07369278
- MOL File:
- 66335-38-4.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Product description | Number | Pack Size | Price |
| Capecitabine impurity A European Pharmacopoeia (EP) Reference Standard | Y0001643 | 5 mg | $241 |
| Capecitabine Related Compound A certified reference material, pharmaceutical secondary standard | PHR2849 | 50 mg | $576 |
| Capecitabine impurity A European Pharmacopoeia (EP) Reference Standard | Y0001643 | Y0001643 | $218 |
| 5'-Deoxy-5-fluorocytidine >98.0%(HPLC)(T) | D4342 | 1g | $41 |
| 5'-Deoxy-5-fluorocytidine >98.0%(HPLC)(T) | D4342 | 5g | $125 |
| More product size | |||
| Melting point | 196-198°C |
|---|---|
| Boiling point | 437.9±55.0 °C(Predicted) |
| Density | 1.84±0.1 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| pka | 13.65±0.70(Predicted) |
| form | Solid |
| color | White to Light Beige |
| Stability | HYGROSCOPIC |
| Major Application | pharmaceutical small molecule |
| InChI | 1S/C9H12FN3O4/c1-3-5(14)6(15)8(17-3)13-2-4(10)7(11)12-9(13)16/h2-3,5-6,8,14-15H,1H3,(H2,11,12,16)/t3-,5-,6-,8-/m1/s1 |
| InChIKey | YSNABXSEHNLERR-ZIYNGMLESA-N |
| SMILES | FC1=CN(C(=O)N=C1N)[C@@H]2O[C@@H]([C@H]([C@H]2O)O)C |
| CAS DataBase Reference | 66335-38-4(CAS DataBase Reference) |
| FDA UNII | 8RWB05I6ON |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) | ![]() GHS08 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H360-H350 | |||||||||
| Precautionary statements | P261-P305+P351+P338 | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 20/21/22-36/37/38 | |||||||||
| Safety Statements | 26-36-37/39-24/25 | |||||||||
| WGK Germany | WGK 3 | |||||||||
| HS Code | 29349990 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704 |
|
5'-Deoxy-5-fluorocytidine price More Price(68)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | Y0001643 | Capecitabine impurity A European Pharmacopoeia (EP) Reference Standard | 66335-38-4 | 5 mg | $241 | 2026-04-30 | Buy |
| Sigma-Aldrich | PHR2849 | Capecitabine Related Compound A certified reference material, pharmaceutical secondary standard | 66335-38-4 | 50 mg | $576 | 2026-04-30 | Buy |
| Sigma-Aldrich | Y0001643 | Capecitabine impurity A European Pharmacopoeia (EP) Reference Standard | 66335-38-4 | Y0001643 | $218 | 2023-06-20 | Buy |
| TCI Chemical | D4342 | 5'-Deoxy-5-fluorocytidine >98.0%(HPLC)(T) | 66335-38-4 | 1g | $41 | 2026-04-30 | Buy |
| TCI Chemical | D4342 | 5'-Deoxy-5-fluorocytidine >98.0%(HPLC)(T) | 66335-38-4 | 5g | $125 | 2026-04-30 | Buy |
5'-Deoxy-5-fluorocytidine Chemical Properties,Uses,Production
Chemical Properties
White Solid
Uses
A metabolite of Capecitabine.
Definition
ChEBI: 5'-Deoxy-5-fluorocytidine is a N-glycosyl compound.
Synthesis
154361-50-9
66335-38-4
1. Pentyl (1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)-5-fluoro-2-oxo-1,2-dihydropyrimidin-4-yl)carbamate (capecitabine, 4.5 g, 12.5 mmol) was suspended with potassium carbonate (8.8 g, 63.77 mmol) in methanol (250 mL) and N,N- dimethylformamide (DMF, 10 mL). The mixture was heated to reflux for 24 hours. Upon completion of the reaction, the reaction solution was cooled and concentrated to dryness under reduced pressure at below 45 °C. The residue was dissolved in hot methanol, filtered and washed with hot methanol. The filtrate was pre-adsorbed on silica gel and purified by fast column chromatography using 50% methanol/ethyl acetate as eluent to afford 1-[3,4-dihydroxy-5-methyltetrahydrofuran-2-yl]-4-amino-1H-pyrimidin-2-one (3.0 g, 90% yield). 2. The above product (3.0 g) was suspended in chloroform (125 mL) and heated to 50 °C. The product (3.0 g) was added to the mixture. Acetic acid (2 mL, 34 mmol) and acetyl chloride (20 mL, 206 mmol) were added sequentially and stirred at 50 °C for 7 hours, followed by continued stirring at 20 °C for 72 hours. At the end of the reaction, ether (100 mL) was added, the solid was collected by filtration and washed with ether to afford 1-[3,4-diacetoxy-5-methyltetrahydrofuran-2-yl]-4-amino-1H-pyrimidin-2-one hydrochloride (4.0 g, 90% yield). 3. The above hydrochloride (2.07 g, 5.7 mmol) was dissolved in pyridine (1.4 mL, 17.4 mmol) and dichloromethane (DCM, 15 mL) with 5-nitrothiophen-2-ylmethanol (1.47 g, 9.3 mmol). A 2M toluene solution of phosgene (3.6 mL, 7.2 mmol) was slowly added at 0 °C and stirred for 2.5 h. After 2.5 h, the same amount of phosgene solution was added again and stirring was continued for 2 h at 0 °C, followed by 18 h of refrigeration. The reaction solution was partitioned with ethyl acetate and brine, the aqueous phase was extracted with ethyl acetate, the organic phases were combined, dried and concentrated under reduced pressure. The residue was purified by silica gel column chromatography with 2% methanol/DCM as eluent to give an off-white foamy product (400 mg, 14% yield). Thin layer chromatography (TLC) showed Rf=0.45 (2% methanol/ethyl acetate as unfolding agent). Liquid chromatography-mass spectrometry (LC-MS) analysis showed a retention time of 4.68 min (TFA 20-50% gradient) and a mass m/z of 201/159/143. nuclear magnetic resonance hydrogen spectra (1H NMR, 500 MHz, DMSO-d6) δ 11.20 (1H, broad single peak, NH), 8.3 (1H, broad peak, NCH=CF). 8.05 (1H, single peak, HarH), 7.30 (1H, single peak, HarH), 5.80 (1H, single peak, NCHO), 5.42 (3H, multiple peaks, HarCH2OCONH, CHOAc), 5.15 (1H, single peak, CHOAc), 4.05 (1H, multiple peaks, OCHCH3), 3.45 (2H, multiple peak, 2×CHOAc), 2.48 (3H, single peak, OAc), 2.05 (3H, single peak, OAc), 1.37 (3H, single peak, OCHCH3) ppm.
References
[1] Patent: WO2006/32921, 2006, A1. Location in patent: Page/Page column 37-38
5'-Deoxy-5-fluorocytidine Preparation Products And Raw materials
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Hebei Chuanghai Biotechnology Co., Ltd | +86-15350571055 | Sibel@chuanghaibio.com | China | 8737 | 58 |
| Hangzhou Measure Life Technology Co., LTD | 13343730176 | 2924244016@qq.com | China | 83 | 58 |
| Capot Chemical Co.,Ltd. | +86-(0)57185586718 +86-13336195806 | sales@capot.com | China | 29626 | 60 |
| Beijing Cooperate Pharmaceutical Co.,Ltd | 010-60279497 | sales01@cooperate-pharm.com | CHINA | 1796 | 55 |
| Henan Tianfu Chemical Co.,Ltd. | +86-0371-55170693 +86-19937530512 | info@tianfuchem.com | China | 21531 | 55 |
| career henan chemical co | +86-0371-86658258 | sales@coreychem.com | China | 29766 | 58 |
| Biochempartner | 0086-13720134139 | candy@biochempartner.com | CHINA | 963 | 58 |
| Shenzhen Nexconn Pharmatechs Ltd | +86-755-89396905 +86-15013857715 | admin@nexconn.com | China | 10399 | 58 |
| Wuhan Chemwonders Technology Inc. | 027-85778276 | info@chemwonders.com | CHINA | 174 | 58 |
| Xiamen AmoyChem Co., Ltd | +86-86-5926051114 | sales@amoychem.com | China | 6361 | 58 |
View Lastest Price from 5'-Deoxy-5-fluorocytidine manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
![]() |
2026-08-07 | 5'-Deoxy-5-fluorocytidine
66335-38-4
|
1kg | 99% | 100kg | WUHAN FORTUNA CHEMICAL CO., LTD | ||
![]() |
2026-03-20 | 5'-Deoxy-5-fluorocytidine
66335-38-4
|
$10.00 | 100KG | 99% | 100 mt | Hebei Chuanghai Biotechnology Co., Ltd | |
![]() |
2025-05-26 | 5'-Deoxy-5-fluorocytidine
66335-38-4
|
$5.00 | 1kg | 0.99 | 10000 | Hebei Fengjia New Material Co., Ltd |
-

- 5'-Deoxy-5-fluorocytidine
66335-38-4
- $0.00
- 99%
- WUHAN FORTUNA CHEMICAL CO., LTD
-

- 5'-Deoxy-5-fluorocytidine
66335-38-4
- $10.00
- 99%
- Hebei Chuanghai Biotechnology Co., Ltd
-

- 5'-Deoxy-5-fluorocytidine
66335-38-4
- $5.00
- 0.99
- Hebei Fengjia New Material Co., Ltd
66335-38-4(5'-Deoxy-5-fluorocytidine)Related Search:
1of4





