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Technical details about CAS 13035-19-3, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: Piperidin-4-amine, 13035-19-3, 4-piperidinamine, 4-amino piperidine, Piperidin-4-ylamine, 4-piperidineamine
Molecular Formula
C5H12N2
Molecular Weight
100.16  g/mol
InChI Key
BCIIMDOZSUCSEN-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
piperidin-4-amine
2.1.2 InChI
InChI=1S/C5H12N2/c6-5-1-3-7-4-2-5/h5,7H,1-4,6H2
2.1.3 InChI Key
BCIIMDOZSUCSEN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CNCCC1N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Piperidin-4-amine

2. 13035-19-3

3. 4-piperidinamine

4. 4-amino Piperidine

5. Piperidin-4-ylamine

6. 4-piperidineamine

7. Pperdn-4-amne

8. 4-amino-piperidine

9. 4- Aminopiperidine

10. Mfcd02179399

11. Schembl62516

12. 4-piperidinamine Dihydrochloride

13. Chembl174570

14. Dtxsid80329842

15. Act05214

16. Albb-027340

17. Bcp01546

18. Zinc2381215

19. Akos000184342

20. Ab11093

21. Am85323

22. Cs-w004330

23. Lf-0513

24. Bp-10687

25. Db-024675

26. Bb 0220565

27. Ft-0617603

28. J-005798

29. J-523968

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 100.16 g/mol
Molecular Formula C5H12N2
XLogP3-0.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass100.100048391 g/mol
Monoisotopic Mass100.100048391 g/mol
Topological Polar Surface Area38 Ų
Heavy Atom Count7
Formal Charge0
Complexity48
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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