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Technical details about Fluoropyrimidine, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 31575-35-6, Pyrimidine, 2-fluoro-, 2-fluoro-pyrimidine, Pyrimidine, fluoro-, Fluoropyrimidine, Mfcd08059530
Molecular Formula
C4H3FN2
Molecular Weight
98.08  g/mol
InChI Key
WAVYAFBQOXCGSZ-UHFFFAOYSA-N

Fluoropyrimidine is any fluoropyrimidine-based agent with potential antineoplastic activity. As an antimetabolite, a fluoropyrimidine interferes with pyrimidine utilization and incorporation into DNA and RNA.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-fluoropyrimidine
2.1.2 InChI
InChI=1S/C4H3FN2/c5-4-6-2-1-3-7-4/h1-3H
2.1.3 InChI Key
WAVYAFBQOXCGSZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CN=C(N=C1)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 31575-35-6

2. Pyrimidine, 2-fluoro-

3. 2-fluoro-pyrimidine

4. Pyrimidine, Fluoro-

5. Fluoropyrimidine

6. Mfcd08059530

7. Pyrimidine,2-fluoro-

8. Amy088

9. Dtxsid40185466

10. Zinc6119128

11. Bbl103780

12. Stl557590

13. Akos005258968

14. Zinc329788201

15. Cs-w018601

16. Sb55512

17. As-57144

18. A820916

19. J-509528

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 98.08 g/mol
Molecular Formula C4H3FN2
XLogP30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass98.02802627 g/mol
Monoisotopic Mass98.02802627 g/mol
Topological Polar Surface Area25.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity51.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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