4phenyl-4-piperidinol

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Also known as: 40807-61-2, 4-hydroxy-4-phenylpiperidine, 4-phenyl-4-piperidinol, 4-piperidinol, 4-phenyl-, 4-phenyl-piperidin-4-ol, Nsc71658

Molecular Formula

C₁₁H₁₅NO

Molecular Weight

177.24 g/mol

InChI Key

KQKFQBTWXOGINC-UHFFFAOYSA-N

1 2D Structure

CAS 40807-61-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-phenylpiperidin-4-ol

2.1.2 InChI

InChI=1S/C11H15NO/c13-11(6-8-12-9-7-11)10-4-2-1-3-5-10/h1-5,12-13H,6-9H2

2.1.3 InChI Key

KQKFQBTWXOGINC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CNCCC1(C2=CC=CC=C2)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 40807-61-2

2. 4-hydroxy-4-phenylpiperidine

3. 4-phenyl-4-piperidinol

4. 4-piperidinol, 4-phenyl-

5. 4-phenyl-piperidin-4-ol

6. Nsc71658

7. Einecs 255-089-0

8. Nsc 71658

9. 4phenyl-4-piperidinol

10. 4-phenyl-4-piperidol

11. 4-phenyl-piperidine-4-ol

12. 4-hydroxy-4phenylpiperidine

13. 4-hydroxy4-phenylpiperidine

14. 4-phenyl-4-piperidinol #

15. 4-hydroxy-4-phenylpiperdine

16. Dsstox_cid_31527

17. Dsstox_rid_97412

18. Dsstox_gsid_57738

19. 4-phenyl-4-hydroxypiperidine

20. 4-hydroxyl-4-phenylpiperidine

21. Schembl306026

22. 4-hydroxy -4-phenylpiperidine

23. 4-hydroxy-4-phenyl Piperidine

24. 4-hydroxy-4-phenyl-piperidine

25. Chembl3561572

26. Dtxsid2057738

27. Amy3467

28. Bcp22953

29. Zinc4804219

30. Tox21_113808

31. 4-hydroxy-4-phenylpiperidine, 99%

32. Mfcd00006000

33. Nsc-71658

34. Akos009156866

35. Cs-w017362

36. Ps-5180

37. Sb17524

38. Ncgc00253684-01

39. Ac-10978

40. Cas-40807-61-2

41. Db-012202

42. Ft-0616668

43. H0925

44. Sr-01000944740

45. Sr-01000944740-1

46. W-106331

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₅NO
Molecular Weight	177.24 g/mol
XLogP3	1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	177.115364102 g/mol
Monoisotopic Mass	177.115364102 g/mol
Topological Polar Surface Area	32.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	158
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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