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2(1H)-Pyrimidinone,4-amino-6-fluoro-

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Name

2(1H)-Pyrimidinone,4-amino-6-fluoro-

EINECS N/A
CAS No. 2193-47-7 Density 1.73 g/cm3
PSA 71.77000 LogP 0.07240
Solubility N/A Melting Point N/A
Formula C4H4FN3O Boiling Point N/A
Molecular Weight 129.094 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 2193-47-7 (6-FLUOROCYTOSINE) Hazard Symbols N/A
Synonyms

4-Amino-6-fluoro-2(1H)-pyrimidinone;

 

2(1H)-Pyrimidinone,4-amino-6-fluoro- Specification

The 2(1H)-Pyrimidinone,4-amino-6-fluoro-, with the CAS registry number of 2193-47-7, is also known as 4-Amino-6-fluoro-2(1H)-pyrimidinone. It belongs to the product category of Pyrimidine. This chemical's molecular formula is C4H4FN3O and molecular weight is 129.092463. What's more, its IUPAC name is 4-Amino-6-fluoro-1H-pyrimidin-2-one.

Physical properties about the 2(1H)-Pyrimidinone,4-amino-6-fluoro- are: (1)ACD/LogP: -1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 2.55; (6)ACD/KOC (pH 7.4): 2.49; (7)#H bond acceptors: 4; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 35.91 Å2; (11)Index of Refraction: 1.649; (12)Molar Refractivity: 27.17 cm3; (13)Molar Volume: 74.5 cm3; (14)Surface Tension: 58.8 dyne/cm; (15)Density: 1.73 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: F\C1=C\C(=N/C(=O)N1)\N
(2) InChI: InChI=1/C4H4FN3O/c5-2-1-3(6)8-4(9)7-2/h1H,(H3,6,7,8,9)
(3) InChIKey: KFYFUDYZSBIDHZ-UHFFFAOYAZ

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