Capecitabine-2',3'-cyclic Carbonate
- Product Name
- Capecitabine-2',3'-cyclic Carbonate
- CAS No.
- 921769-65-5
- Chemical Name
- Capecitabine-2',3'-cyclic Carbonate
- Synonyms
- Capecitabine USP RC C;Capecitabine USP IMp.C;Capecitabine EP Impurity F;Capecitabine-2',3'-cyclic Carbonate;Capacitabine USP Related Compound C;Capecitabine USP Related Compound C;2-hydroxy-11-(methylthio)butanamide;CAPECITABINE related substance USP C;Capecitabine-2'',3''-cyclic Carbonate;Capecitabine-2',3'-cyclic carbonate, 98.5%
- CBNumber
- CB42503059
- Molecular Formula
- C16H20FN3O7
- Formula Weight
- 385.34
- MOL File
- 921769-65-5.mol
Capecitabine-2',3'-cyclic Carbonate Property
- Melting point:
- 68-69°C
- Density
- 1.58±0.1 g/cm3(Predicted)
- storage temp.
- -20°C Freezer
- solubility
- DMSO (Sparingly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- 5.34±0.40(Predicted)
- color
- White
- Major Application
- pharmaceutical (small molecule)
- InChIKey
- VTAMAYSBXXKQPB-IZSYJUOESA-N
- SMILES
- FC1=CN(C(=O)N=C1NC(=O)OCCCCC)[C@@H]2O[C@@H](C3OC(=O)O[C@@H]32)C
Safety
- Safety Statements
- 24/25
- WGK Germany
- WGK 3
- HS Code
- 29349990
- Storage Class
- 11 - Combustible Solids
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
- Precautionary statements
-
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P332+P313IF SKIN irritation occurs: Get medical advice/attention.
P337+P313IF eye irritation persists: Get medical advice/attention.
N-Bromosuccinimide Price
- Product number
- C175660
- Product name
- Capecitabine-2'',3''-cyclicCarbonate
- Packaging
- 5mg
- Price
- $130
- Updated
- 2021/12/16
- Product number
- C175660
- Product name
- Capecitabine-2'',3''-cyclicCarbonate
- Packaging
- 25mg
- Price
- $435
- Updated
- 2021/12/16
- Product number
- API0046145
- Product name
- CAPECITABINE EP IMPURITY C
- Purity
- 95.00%
- Packaging
- 5MG
- Price
- $456.76
- Updated
- 2021/12/16
- Product number
- NC16644
- Product name
- Capecitabine 2',3'-cyclic carbonate
- Packaging
- 25mg
- Price
- $700
- Updated
- 2021/12/16
- Product number
- NC16644
- Product name
- Capecitabine 2',3'-cyclic carbonate
- Packaging
- 5mg
- Price
- $160
- Updated
- 2021/12/16
Capecitabine-2',3'-cyclic Carbonate Chemical Properties,Usage,Production
Chemical Properties
Off-White Solid
Uses
Capecitabine-2'',3''-cyclic Carbonate (Capecitabine EP Impurity F) is a capecitabine related compound C is an impurity in Capecitabine (C175650), an antineoplastic agent. Capecitabine is a prodrug of Doxifluridine (D556750).
Uses
Capecitabine related compound C.
Synthesis
Weighing 5-fluorocytosine 25.0g in 500ml three-necked bottle, to which added 55ml of toluene, hexamethyldisilamine 2ml, 110 heating reflux 6.5h, after the completion of the reaction, concentrated reaction solution. Then add 26.0g of triacetyl ribose and 200ml of dichloromethane to reduce the temperature to -10~0, add 20ml of tin tetrachloride and 50ml of dichloromethane mixed solution dropwise, react for 8h, adjust the pH with aqueous sodium bicarbonate to 4~5, and then extract with dichloromethane for two times, merge the organic phases, and then obtain the condensate by evaporation and concentration.
Add n-pentyl chloroformate 30 mlg, dichloromethane 100 ml, pyridine 20 ml to the condensate, react at -15 for 2h, adjust pH4-6 with hydrochloric acid, stratify, and concentrate the organic layer to obtain oil.
Add 100ml of acetic anhydride to the oil, heat and reflux for 15h, evaporate the acetic anhydride under reduced pressure, add 450ml of water and 400ml of trichloromethane to extract, 200ml of water washed three times. The trichloromethane layer was concentrated to obtain an oil, which was extracted by dichloromethane and concentrated to obtain an oil.
Finally, it was separated on a silica gel column eluting with ethyl acetate and petroleum ether 1:1, and the final product was collected, concentrated and dried to obtain the white-like compound with high purity.1H-NMR (400MHz, CDCl3)δ0.1.0~1.07 (t, 3h), 1.20(t,3H), 1.29(d,2H), 1.34~1.36(d,4H), 1.57(d,4H), 1.57(d,4H), 1.57(d,4H), 1.57(d,4H), 1.57(d,4H), 1.57(d,4H). ), 1.57 (d,2H), 4.08 (d,2H), 4.55 (d,2H), 4.59~4.60 (s,2H), 5.94 (d,2H), 6.93 (m,1H) 8.0 (s,1H). Liquid phase purity 99% .
Capecitabine-2',3'-cyclic Carbonate Preparation Products And Raw materials
Raw materials
Preparation Products
Capecitabine-2',3'-cyclic Carbonate Suppliers
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View Lastest Price from Capecitabine-2',3'-cyclic Carbonate manufacturers
- Product
- Capecitabine Impurity 921769-65-5
- Price
- US $0.00-0.00/mg
- Min. Order
- 10mg
- Purity
- 98
- Supply Ability
- 100000000
- Release date
- 2024-12-09
- Product
- Capecitabine-2',3'-cyclic Carbonate 921769-65-5
- Price
- US $7.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 100KG
- Release date
- 2020-01-13