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Chemistry

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Also known as: 92-94-4, 1,4-diphenylbenzene, 1,1':4',1''-terphenyl, P-diphenylbenzene, P-triphenyl, Santowax p
Molecular Formula
C18H14
Molecular Weight
230.3  g/mol
InChI Key
XJKSTNDFUHDPQJ-UHFFFAOYSA-N
FDA UNII
GWP218ZY6F

P-Terphenyl
1 2D Structure

P-Terphenyl

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1,4-diphenylbenzene
2.1.2 InChI
InChI=1S/C18H14/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h1-14H
2.1.3 InChI Key
XJKSTNDFUHDPQJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3
2.2 Other Identifiers
2.2.1 UNII
GWP218ZY6F
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 92-94-4

2. 1,4-diphenylbenzene

3. 1,1':4',1''-terphenyl

4. P-diphenylbenzene

5. P-triphenyl

6. Santowax P

7. 4-phenylbiphenyl

8. 4-phenyldiphenyl

9. Para-terphenyl

10. Biphenyl, 4-phenyl-

11. 1,1'-biphenyl, 4-phenyl-

12. Nsc 6810

13. Ptp

14. 4-phenyl-1,1'-biphenyl

15. Gwp218zy6f

16. Chembl491582

17. Chebi:52242

18. Nsc-6810

19. Pyrogallol Tannin

20. Tannin From Pyrogallol

21. P-terphenyl Suitable For Scintillation

22. Ccris 1657

23. Hsdb 5280

24. Einecs 202-205-2

25. Unii-gwp218zy6f

26. Triphenyl-

27. Ai3-00847

28. [1,1';4',1'']terphenyl

29. Ppp (scintillator)

30. Mfcd00003061

31. Tannin Pyrogallol

32. Terphenyl, P-

33. P-phenylene Trimer

34. Dsstox_cid_7888

35. Wln: Rr Dr

36. Dsstox_rid_78673

37. Dsstox_gsid_29121

38. 1,1':4',1"-terphenyl

39. Dtxsid6029121

40. P-terphenyl, Analytical Standard

41. Nsc6810

42. Zinc1867001

43. Tox21_202759

44. Bdbm50260180

45. P-terphenyl, >=99.5% (hplc)

46. Stl069547

47. P-terphenyl (purified By Sublimation)

48. Akos005111366

49. 1,1'':4'',1''''-terphenyl

50. Cs-w014689

51. Cas-92-94-4

52. Ncgc00164113-01

53. Ncgc00260306-01

54. Ac-18695

55. As-12803

56. Db-038209

57. Ft-0659947

58. T0020

59. T3263

60. D92686

61. T-3203

62. 003t061

63. A844395

64. Ab-131/40897106

65. W-100265

66. Q20965188

67. F0486-1779

68. Z1262246140

69. P-terphenyl, Suitable For Scintillation, >=98.5% (hplc)

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 230.3 g/mol
Molecular Formula C18H14
XLogP35.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass230.109550447 g/mol
Monoisotopic Mass230.109550447 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count18
Formal Charge0
Complexity198
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 Absorption, Distribution and Excretion

...POORLY ABSORBED & LARGELY EXCRETED UNCHANGED IN FECES.

Gosselin, R.E., H.C. Hodge, R.P. Smith, and M.N. Gleason. Clinical Toxicology of Commercial Products. 4th ed. Baltimore: Williams and Wilkins, 1976., p. II-105


4.2 Metabolism/Metabolites

Depending on the extent to which these compounds are absorbed, the various terphenyls were metabolized to glucuronic acid conjugates and phenol and excreted in the urine of treated rabbits. Following a single 1 gram oral dose of o-, m-, or p-terphenyl, 60% of the o-, 38% of the m-, and a trace of p-terphenyl were detected as their respective glucuronides in the urine. Zero, 15%, and 30% of the o-, m-, and p-terphenyls, respectively, were isolated unchanged in feces.

American Conference of Governmental Industrial Hygienists, Inc. Documentation of the Threshold Limit Values and Biological Exposure Indices. 6th ed. Volumes I, II, III. Cincinnati, OH: ACGIH, 1991., p. 1500


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