CAS 930-68-7 manufacturers and suppliers on PharmaCompass

PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as: Cyclohex-2-enone, Cyclohex-2-en-1-one, 930-68-7, 2-cyclohexenone, Cyclohexenone, 3-oxocyclohexene
Molecular Formula
C6H8O
Molecular Weight
96.13  g/mol
InChI Key
FWFSEYBSWVRWGL-UHFFFAOYSA-N
FDA UNII
445160R1U6

CAS 930-68-7
cyclohexenone is a natural product found in Solanum stuckertii and Lindera glauca with data available.
1 2D Structure

CAS 930-68-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
cyclohex-2-en-1-one
2.1.2 InChI
InChI=1S/C6H8O/c7-6-4-2-1-3-5-6/h2,4H,1,3,5H2
2.1.3 InChI Key
FWFSEYBSWVRWGL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC=CC(=O)C1
2.2 Other Identifiers
2.2.1 UNII
445160R1U6
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 2-cyclohexen-1-one, 18o-labeled

2. 2-cyclohexen-1-one, Ion(1-)

3. 2-cyclohexenone

2.3.2 Depositor-Supplied Synonyms

1. Cyclohex-2-enone

2. Cyclohex-2-en-1-one

3. 930-68-7

4. 2-cyclohexenone

5. Cyclohexenone

6. 3-oxocyclohexene

7. Cyclohexen-3-one

8. 1-cyclohexen-3-one

9. Cyclohexen-1-one

10. 2-cyclohexene-1-one

11. Cyclohexen-2-one

12. Chebi:15977

13. Mfcd00001577

14. Nsc-59710

15. 445160r1u6

16. 2-cyclohexenone-1

17. Einecs 213-223-5

18. Nsc 59710

19. 25512-62-3

20. Brn 1280477

21. 2-cyclohexeneone

22. Unii-445160r1u6

23. A2q

24. Cyclohexenone, 18

25. 2-cyclohexane-1-one

26. Dsstox_cid_4881

27. Wln: L6v Butj

28. Epitope Id:141515

29. Dsstox_rid_77564

30. Dsstox_gsid_24881

31. 4-07-00-00124 (beilstein Handbook Reference)

32. Mls001065611

33. Chembl1439332

34. Dtxsid1024881

35. Fema No. 4517

36. Cyclohexene-1-one, 2-

37. 2-cyclohexen-1-one, >=95%

38. Bdbm217391

39. Hms3039a04

40. Nsc59710

41. Tox21_200008

42. Stl141084

43. Akos004909928

44. Zinc100004096

45. Ncgc00091479-01

46. Ncgc00091479-02

47. Ncgc00257562-01

48. Cas-930-68-7

49. Smr000568463

50. Db-057364

51. Ft-0606446

52. C02395

53. Q209370

54. J-509238

55. F0001-2243

56. Z955123690

57. 2-cyclohexen-1-one, Produced By Basf, >=98.0% (gc)

2.4 Create Date
2004-09-16
3 Chemical and Physical Properties
Molecular Weight 96.13 g/mol
Molecular Formula C6H8O
XLogP30.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass96.057514874 g/mol
Monoisotopic Mass96.057514874 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count7
Formal Charge0
Complexity103
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

Upload your portfolio for free, ask us
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty