Tetrahydropyranyloxy Phenol

Synopsis, Chemistry

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Also known as: 53936-56-4, 4-((tetrahydro-2h-pyran-2-yl)oxy)phenol, 4-(oxan-2-yloxy)phenol, Tetrahydropyranyloxy phenol, 4-(tetrahydro-2h-pyran-2-yloxy)phenol, Girlite da 100

Molecular Formula

C₁₁H₁₄O₃

Molecular Weight

194.23 g/mol

InChI Key

GFBCWCDNXDKFRH-UHFFFAOYSA-N

FDA UNII

RG969BY5EN

1 2D Structure

Tetrahydropyranyloxy Phenol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-(oxan-2-yloxy)phenol

2.1.2 InChI

InChI=1S/C11H14O3/c12-9-4-6-10(7-5-9)14-11-3-1-2-8-13-11/h4-7,11-12H,1-3,8H2

2.1.3 InChI Key

GFBCWCDNXDKFRH-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCOC(C1)OC2=CC=C(C=C2)O

2.2 Other Identifiers

2.2.1 UNII

RG969BY5EN

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 4-((tetrahydro-2h-pyran-2-yl)oxy)phenol

2. Xg-d Compound

2.3.2 Depositor-Supplied Synonyms

1. 53936-56-4

2. 4-((tetrahydro-2h-pyran-2-yl)oxy)phenol

3. 4-(oxan-2-yloxy)phenol

4. Tetrahydropyranyloxy Phenol

5. 4-(tetrahydro-2h-pyran-2-yloxy)phenol

6. Girlite Da 100

7. (+/-)-tetrahydropyranyloxy Phenol

8. Tetrahydropyranyloxy Phenol [inci]

9. 4-((2-tetrahydropyranyl)oxy)phenol

10. Phenol, 4-[(tetrahydro-2h-pyran-2-yl)oxy]-

11. Tetrahydropyranyloxy Phenol, (+/-)-

12. 4-hydroxyphenyl Tetrahydropyranyl Ether

13. Rg969by5en

14. Phenol, 4-((tetrahydro-2h-pyran-2-yl)oxy)-

15. 4-[(2-tetrahydropyranyl)oxy]phenol

16. Mfcd09970981

17. Unii-rg969by5en

18. D-arbutin

19. 4-[(oxan-2-yl)oxy]phenol

20. Schembl222919

21. Chembl4303145

22. Dtxsid10968728

23. Hms3652a20

24. Hy-b1461

25. S4132

26. 4-(tetrahydro-pyran-2-yloxy)-phenol

27. Akos015919608

28. Ccg-266537

29. Cs-5188

30. Ncgc00386258-01

31. Ac-23368

32. As-18645

33. Sy102928

34. Ft-0686550

35. Sw219682-1

36. Ab01566911_01

37. 936d564

38. A847928

39. Q27288101

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₄O₃
Molecular Weight	194.23 g/mol
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	194.094294304 g/mol
Monoisotopic Mass	194.094294304 g/mol
Topological Polar Surface Area	38.7 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	164
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1