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2D Structure
Also known as: 444731-72-0, 2,3-dimethylindazol-6-amine, 2,3-dimethyl-6-amino-2h-indazole, 6-amino-2,3-dimethyl-2h-indazole, 2,3-dimethyl-2h-indazol-6-ylamine, Schembl588669
Molecular Formula
C9H11N3
Molecular Weight
161.20  g/mol
InChI Key
PVNVSSNARYHLRF-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,3-dimethylindazol-6-amine
2.1.2 InChI
InChI=1S/C9H11N3/c1-6-8-4-3-7(10)5-9(8)11-12(6)2/h3-5H,10H2,1-2H3
2.1.3 InChI Key
PVNVSSNARYHLRF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C2C=CC(=CC2=NN1C)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 444731-72-0

2. 2,3-dimethylindazol-6-amine

3. 2,3-dimethyl-6-amino-2h-indazole

4. 6-amino-2,3-dimethyl-2h-indazole

5. 2,3-dimethyl-2h-indazol-6-ylamine

6. Schembl588669

7. Amy288

8. Dtxsid10468278

9. Bcp12745

10. Cs-b0766

11. Mfcd09258896

12. Zinc31777127

13. Akos006330849

14. Gs-6672

15. Pb26443

16. Ac-24856

17. Db-037970

18. Ft-0684739

19. 731d720

20. A826589

21. J-518217

22. Z2182115473

23. 2,3-dimethylindazol-6-amine;2,3-dimethyl-2h-indazol-6-amine

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 161.20 g/mol
Molecular Formula C9H11N3
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass161.095297364 g/mol
Monoisotopic Mass161.095297364 g/mol
Topological Polar Surface Area43.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity171
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1