CAS 86087-23-2

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Also known as: 86087-23-2, (s)-tetrahydrofuran-3-ol, (3s)-oxolan-3-ol, (s)-3-hydroxytetrahydrofuran, (s)-(+)-tetrahydro-3-furanol, (s)-tetrahydro-3-furanol

Molecular Formula

C₄H₈O₂

Molecular Weight

88.11 g/mol

InChI Key

XDPCNPCKDGQBAN-BYPYZUCNSA-N

1 2D Structure

CAS 86087-23-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3S)-oxolan-3-ol

2.1.2 InChI

InChI=1S/C4H8O2/c5-4-1-2-6-3-4/h4-5H,1-3H2/t4-/m0/s1

2.1.3 InChI Key

XDPCNPCKDGQBAN-BYPYZUCNSA-N

2.1.4 Canonical SMILES

C1COCC1O

2.1.5 Isomeric SMILES

C1COC[C@H]1O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 86087-23-2

2. (s)-tetrahydrofuran-3-ol

3. (3s)-oxolan-3-ol

4. (s)-3-hydroxytetrahydrofuran

5. (s)-(+)-tetrahydro-3-furanol

6. (s)-tetrahydro-3-furanol

7. 3-furanol, Tetrahydro-, (3s)-

8. 84976-47-6

9. Mfcd00064327

10. S-(+)-3-hydroxytetrahydrofuran

11. (s)-(+)-tetrahyro-3-furanol

12. Oxolane-3beta-ol

13. (3s)-tetrahydrofuran-3-ol

14. Tetrahydro-3-furanol #

15. (s)-tetrahydro-furan-3-ol

16. 3-(s)-hydroxytetrahydrofuran

17. (s)-(+)-tetrahydrofuran-3-ol

18. Dtxsid50893863

19. (+)-(s)-3-hydroxytetrahydrofuran

20. (s)-(+)3-hydroxy-tetrahydrofuran

21. Act05256

22. Cs-d0600

23. Zinc4716350

24. (3s)-(+)-3-hydroxytetrahydrofuran

25. (s)-(+)-3-hydroxy-tetrahydrofuran

26. Ac-491

27. (s)-(+)-3-hydroxy-tetrahydrofurane

28. Akos005145535

29. Akos015908999

30. Ac-1844

31. Ps-9362

32. Wt81754

33. Am20110236

34. T1716

35. 2-furanyl,tetrahydro-3-hydroxy-, (r)- (9ci)

36. 087h232

37. Q-200032

38. (s)-tetrahydrofuran-3-ol;(s)-tetrahydro-3-furanol

2.3 Create Date

2005-07-19

3 Chemical and Physical Properties

Molecular Formula	C₄H₈O₂
Molecular Weight	88.11 g/mol
XLogP3	-0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	88.052429494 g/mol
Monoisotopic Mass	88.052429494 g/mol
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	44.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1