2,4(1H,3H)-Pyrimidinedione,6-fluoro- supplier

Name
6-FLUOROURACIL
EINECS
CAS No. 591-36-6
Article Data4
CAS DataBase
Density 1.53 g/cm³
Solubility
Melting Point
Formula C₄H₃FN₂O₂
Boiling Point 450.5 °C at 760 mmHg
Molecular Weight 130.078
Flash Point 226.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Uracil,6-fluoro- (8CI);6-Fluorouracil;NSC 528881;
PSA 65.72000
LogP -0.79770

2,4(1H,3H)-Pyrimidinedione,6-fluoro- Specification

The 2,4(1H,3H)-Pyrimidinedione,6-fluoro-, with the CAS registry number 591-36-6, is also known as NSC528881. It belongs to the product categories of Pyrimidine; Pyridines, Pyrimidines, Purines and Pteredines. This chemical's molecular formula is C₄H₃FN₂O₂ and molecular weight is 130.0772. Its IUPAC name is called 6-fluoro-1H-pyrimidine-2,4-dione.

Physical properties of 2,4(1H,3H)-Pyrimidinedione,6-fluoro-: (1)ACD/LogP: -0.78; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 2; (8)Index of Refraction: 1.523; (9)Molar Refractivity: 25.85 cm³; (10)Molar Volume: 84.5 cm³; (11)Surface Tension: 46.1 dyne/cm; (12)Density: 1.53 g/cm³; (13)Flash Point: 226.3 °C; (14)Enthalpy of Vaporization: 73.67 kJ/mol; (15)Boiling Point: 450.5 °C at 760 mmHg; (16)Vapour Pressure: 9.83E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1\C=C(\F)NC(=O)N1
(2)InChI: InChI=1/C4H3FN2O2/c5-2-1-3(8)7-4(9)6-2/h1H,(H2,6,7,8,9)
(3)InChIKey: ZARBPJCRKSPIRN-UHFFFAOYAI

Product Name

6-FLUOROURACIL

2,4(1H,3H)-Pyrimidinedione,6-fluoro- Specification

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