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CAS 17132-78-4
PharmaCompass
  • Chemistry
CAS 17132-78-4
Also known as: 2,3-dicyanopyridine, 17132-78-4, 2,3-pyridinedicarbonitrile, Pyridine-2,3-dicarbonitirle, Dicyanopyridine, Sbb055634
Molecular Formula
C7H3N3
Molecular Weight
129.122  g/mol
InChI Key
GHFGOVUYCKZOJH-UHFFFAOYSA-N

1 2D Structure

CAS 17132-78-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
pyridine-2,3-dicarbonitrile
2.1.2 InChI
InChI=1S/C7H3N3/c8-4-6-2-1-3-10-7(6)5-9/h1-3H
2.1.3 InChI Key
GHFGOVUYCKZOJH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(N=C1)C#N)C#N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 2,3-dicyanopyridine

2. 17132-78-4

3. 2,3-pyridinedicarbonitrile

4. Pyridine-2,3-dicarbonitirle

5. Dicyanopyridine

6. Sbb055634

7. Pyridinedicarbonitrile

8. Acmc-209e2p

9. Ac1l1f1s

10. Schembl18611

11. Ctk0h9495

12. Dtxsid00169060

13. Ghfgovuyckzojh-uhfffaoysa-n

14. Zinc5838523

15. 8811aa

16. Anw-22511

17. Mfcd00191682

18. Akos000280006

19. Fch1116926

20. Mb00858

21. Rtr-007532

22. Tra0005022

23. Vp13987

24. Acm17132784

25. Ac-14254

26. Aj-54991

27. Ak-81507

28. Bc207485

29. He021569

30. He240262

31. Kb-60131

32. Ax8149725

33. Tr-007532

34. Ft-0691371

35. P1218

36. Ks-00001638

37. 189542-ep2274299a1

38. I14-92416

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 129.122 g/mol
Molecular Formula C7H3N3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass129.033 g/mol
Monoisotopic Mass129.033 g/mol
Topological Polar Surface Area60.5 A^2
Heavy Atom Count10
Formal Charge0
Complexity203
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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