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2D Structure
Also known as: 430-99-9, 2-fluoroprop-2-enoic acid, 2-fluoropropenoic acid, Alpha-fluoroacrylic acid, 2-propenoic acid, 2-fluoro-, Unii-bep1a791ci
Molecular Formula
C3H3FO2
Molecular Weight
90.05  g/mol
InChI Key
TYCFGHUTYSLISP-UHFFFAOYSA-N
FDA UNII
BEP1A791CI

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-fluoroprop-2-enoic acid
2.1.2 InChI
InChI=1S/C3H3FO2/c1-2(4)3(5)6/h1H2,(H,5,6)
2.1.3 InChI Key
TYCFGHUTYSLISP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C=C(C(=O)O)F
2.2 Other Identifiers
2.2.1 UNII
BEP1A791CI
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 430-99-9

2. 2-fluoroprop-2-enoic Acid

3. 2-fluoropropenoic Acid

4. Alpha-fluoroacrylic Acid

5. 2-propenoic Acid, 2-fluoro-

6. Unii-bep1a791ci

7. Bep1a791ci

8. 74893-46-2

9. Mfcd03424474

10. 2-fluoroacrylic Acid, Sodium Salt

11. 2-propenoic Acid, Fluoro-

12. C3h3fo2

13. Fluoroacrylic Acid

14. Dtxsid10902405

15. Tycfghutyslisp-uhfffaoysa-n

16. .alpha.-fluoroacrylic Acid

17. Bcp31987

18. Zca89346

19. Akos006230202

20. Am84938

21. Cs-w005285

22. As-57293

23. Sy021247

24. Ft-0676569

25. 2-fluoroprop-2-enoic Acid;2-fluoroacrylic Acid

26. En300-104748

27. A826153

28. J-509509

29. Q27274622

30. 2-fluoroprop-2-enoic Acid;2-propenoic Acid, 2-fluoro-

2.4 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 90.05 g/mol
Molecular Formula C3H3FO2
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area37.3
Heavy Atom Count6
Formal Charge0
Complexity86.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1