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Also known as: 771-99-3, 4-phenyl-piperidine, Piperidine, 4-phenyl-, 4-phenyl piperidine, Mfcd00006002, 4-(phenyl)piperidine
Molecular Formula
C11H15N
Molecular Weight
161.24  g/mol
InChI Key
UTBULQCHEUWJNV-UHFFFAOYSA-N
FDA UNII
8V8IM567WT

CAS 771-99-3
1 2D Structure

CAS 771-99-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-phenylpiperidine
2.1.2 InChI
InChI=1S/C11H15N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-5,11-12H,6-9H2
2.1.3 InChI Key
UTBULQCHEUWJNV-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CNCCC1C2=CC=CC=C2
2.2 Other Identifiers
2.2.1 UNII
8V8IM567WT
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-phenylpiperidine, (r)-isomer

2. 4-phenylpiperidine, (s)-isomer

2.3.2 Depositor-Supplied Synonyms

1. 771-99-3

2. 4-phenyl-piperidine

3. Piperidine, 4-phenyl-

4. 4-phenyl Piperidine

5. Mfcd00006002

6. 4-(phenyl)piperidine

7. Chembl20969

8. 8v8im567wt

9. Nsc-89743

10. 4-phenylpiperidine 97%

11. 4-phenypiperdine

12. 4-phenyl Piperidin

13. Einecs 212-243-1

14. Nsc 89743

15. (4-phenyl)piperidine

16. 4-phenylpiperidine, 97%

17. Schembl4574

18. Unii-8v8im567wt

19. Ampd00098

20. Utbulqcheuwjnv-uhfffaoysa-

21. Dtxsid40227890

22. Albb-005772

23. Cs-d0605

24. Nsc89743

25. Str04023

26. Zinc1575604

27. Bdbm50007408

28. Stk500866

29. 4-phenyl-1,2,3,5-tetrahydropyridine

30. Akos000208931

31. Ab00564

32. Am85909

33. Lf-0512

34. Ac-23131

35. Sy005151

36. Db-031653

37. A9776

38. Bb 0237057

39. Ft-0619411

40. P1555

41. 771p993

42. Q-102142

43. Q4637198

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 161.24 g/mol
Molecular Formula C11H15N
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass161.120449483 g/mol
Monoisotopic Mass161.120449483 g/mol
Topological Polar Surface Area12 Ų
Heavy Atom Count12
Formal Charge0
Complexity121
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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