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2D Structure
Also known as: 105827-78-9, N-[1-[(6-chloropyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide, 1-((6-chloro-3-pyridinyl)methyl)-4,5-dihydro-n-nitro-imidazol-2-amine, 1-((6-chloro-3-pyridinyl)methyl)-n-nitro-4,5-dihydro-1h-imidazol-2-amine, Imidacloprid [mi], Imidacloprid [hsdb]
Molecular Formula
C9H10ClN5O2
Molecular Weight
255.66  g/mol
InChI Key
YWTYJOPNNQFBPC-UHFFFAOYSA-N
FDA UNII
3BN7M937V8

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-[1-[(6-chloropyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide
2.1.2 InChI
InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)
2.1.3 InChI Key
YWTYJOPNNQFBPC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(C(=N1)N[N+](=O)[O-])CC2=CN=C(C=C2)Cl
2.2 Other Identifiers
2.2.1 UNII
3BN7M937V8
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 105827-78-9

2. N-[1-[(6-chloropyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide

3. 1-((6-chloro-3-pyridinyl)methyl)-4,5-dihydro-n-nitro-imidazol-2-amine

4. 1-((6-chloro-3-pyridinyl)methyl)-n-nitro-4,5-dihydro-1h-imidazol-2-amine

5. Imidacloprid [mi]

6. Imidacloprid [hsdb]

7. Bay Ntn 33893

8. Imidacloprid [mart.]

9. Mls001304087

10. Imidacloprid [green Book]

11. Hms2231f05

12. Hms3373h06

13. Bdbm50212288

14. Mfcd00468059

15. Advocate Component Imidacloprid

16. Akos015895351

17. Imidacloprid Component Of Advocate

18. Imidacloprid [ema Epar Veterinary]

19. Smr000718777

20. Db-042420

21. Ft-0631157

22. Ft-0656073

23. E79264

24. Ab00876233-04

25. A801327

26. J-007111

27. 1-(6-chloro-3-pyridylmethyl)-n-nitromidazolidin-2-ylideneamine

28. 1-((6-chloro-3-pyridinyl)methyl)-4,5-dihydro-n-nitro-1h-imidazol-2-amine

29. 1-[(6-chloropyridin-3-yl)methyl]-n-nitro-4,5-dihydro-1h-imidazol-2-amine

30. 2-chloro-5-{[2-(nitroamino)-4,5-dihydro-1h-imidazol-1-yl]methyl}pyridine

31. N-[1-[(6-chloranylpyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide

32. N-{1-[(6-chloro-3-pyridyl)methyl]-4,5-dihydroimidazol-2-yl}nitramide

33. N-(1-((6-chloropyridin-3-yl)methyl)-4,5-dihydro-1h-imidazol-2-yl)nitramide

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 255.66 g/mol
Molecular Formula C9H10ClN5O2
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass255.0523023 g/mol
Monoisotopic Mass255.0523023 g/mol
Topological Polar Surface Area86.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity319
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1