4-Chloro-2-fluoro-1-nitrobenzene - Uses, DMF, Dossier, Manufacturer, Supplier, Licensing, Distributer, Prices, News, GMP

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Also known as: 4-chloro-2-fluoronitrobenzene, 700-37-8, Benzene, 4-chloro-2-fluoro-1-nitro-, Mfcd00042211, 2-fluoro-4-chloronitrobenzene, 1-chloro-3-fluoro-4-nitrobenzene

Molecular Formula

C₆H₃ClFNO₂

Molecular Weight

175.54 g/mol

InChI Key

PTCPUGKKWNMITF-UHFFFAOYSA-N

1 2D Structure

CAS 700-37-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-chloro-2-fluoro-1-nitrobenzene

2.1.2 InChI

InChI=1S/C6H3ClFNO2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3H

2.1.3 InChI Key

PTCPUGKKWNMITF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C=C1Cl)F)[N+](=O)[O-]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 4-chloro-2-fluoronitrobenzene

2. 700-37-8

3. Benzene, 4-chloro-2-fluoro-1-nitro-

4. Mfcd00042211

5. 2-fluoro-4-chloronitrobenzene

6. 1-chloro-3-fluoro-4-nitrobenzene

7. 4-chloro-2-fluoro-1-nitro-benzene

8. Einecs 211-842-5

9. Schembl29348

10. 5-chloro-2-nitrofluorobenzene

11. 2-fluoro-4-chloro-nitrobenzene

12. 4-chloro-2-fluoro-nitrobenzene

13. Ptcpugkkwnmitf-uhfffaoysa-

14. Dtxsid40220260

15. 2-fluoro-4-chloro-1-nitro-benzene

16. 4-chloro-2-fluoro-1-nitro Benzene

17. 4-chloro-2-fluoro-1-nitrobenzene #

18. Akos005256685

19. Ac-9689

20. Cs-w002202

21. As-14572

22. Sy013131

23. Am20060201

24. Ft-0601438

25. 4-chloro-2-fluoro-1-nitrobenzene, Aldrichcpr

26. A15951

27. En300-152826

28. J-514942

29. W-202320

30. Inchi=1/c6h3clfno2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3h

2.3 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₆H₃ClFNO₂
Molecular Weight	175.54 g/mol
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	45.8
Heavy Atom Count	11
Formal Charge	0
Complexity	161
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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