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2D Structure
Also known as: 39263-34-8, Dtxsid70447701, Dtxcid70398522, 850-344-8, N'-(2-cyano-4-nitrophenyl)-n,n-dimethyliminoformamide, (e)-n'-(2-cyano-4-nitrophenyl)-n,n-dimethylformimidamide
Molecular Formula
C10H10N4O2
Molecular Weight
218.21  g/mol
InChI Key
RLSZPRPVHOOMBN-UHFFFAOYSA-N
FDA UNII
K2H9LRJ9T9

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N'-(2-cyano-4-nitrophenyl)-N,N-dimethylmethanimidamide
2.1.2 InChI
InChI=1S/C10H10N4O2/c1-13(2)7-12-10-4-3-9(14(15)16)5-8(10)6-11/h3-5,7H,1-2H3
2.1.3 InChI Key
RLSZPRPVHOOMBN-UHFFFAOYSA-N
2.2 Other Identifiers
2.2.1 UNII
K2H9LRJ9T9
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 39263-34-8

2. Dtxsid70447701

3. Dtxcid70398522

4. 850-344-8

5. N'-(2-cyano-4-nitrophenyl)-n,n-dimethyliminoformamide

6. (e)-n'-(2-cyano-4-nitrophenyl)-n,n-dimethylformimidamide

7. 1203904-18-0

8. N'-(2-cyano-4-nitrophenyl)-n,n-dimethylformamidine

9. N'-(2-cyano-4-nitrophenyl)-n,n-dimethylformimidamide

10. Nchembio866-comp21

11. Starbld0008938

12. K2h9lrj9t9

13. Schembl1192132

14. Schembl1192134

15. Js-199c

16. Rlszprpvhoombn-kpkjpenvsa-n

17. Rlszprpvhoombn-uhfffaoysa-n

18. (e)-n'-(2-cyano-4-nitrophenyl)-n,n-dimethylmethanimidamide

19. Mfcd09027120

20. Akos005073204

21. Akos030240495

22. F97758

23. En300-11777032

24. N'-(2-cyano-4-nitro-phenyl)-n,n-dimethylformamidine

25. (e)-n'-(2-cyano-4-nitrophenyl)-n,n-dimethylformamidine

26. N'-(2-cyano-4-nitro-phenyl)-n,n-dimethyl-formamidine

27. 2-{[(dimethylamino)methylidene]amino}-5-nitrobenzonitrile

28. (1e)-n'-(2-cyano-4-nitrophenyl)-n,n-dimethylmethanimidamide

29. N'-(2-cyano-4-nitrophenyl)-n,n-dimethylformimidamide, (e)-

30. Methanimidamide, N'-(2-cyano-4-nitrophenyl)-n,n-dimethyl-, (1e)-

2.4 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 218.21 g/mol
Molecular Formula C10H10N4O2
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area85.2
Heavy Atom Count16
Formal Charge0
Complexity325
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1