Cyclobutane Carboxaldehyde manufacturers and suppliers on PharmaCompass

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Also known as: Cyclobutanecarbaldehyde, 2987-17-9, Chembl18475, Mfcd03789631, Cyclobutancarbaldehyd, Cyclobutanecarboaldehyde
Molecular Formula
C5H8O
Molecular Weight
84.12  g/mol
InChI Key
INVYSLWXPIEDIQ-UHFFFAOYSA-N

Cyclobutane Carboxaldehyde
1 2D Structure

Cyclobutane Carboxaldehyde

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
cyclobutanecarbaldehyde
2.1.2 InChI
InChI=1S/C5H8O/c6-4-5-2-1-3-5/h4-5H,1-3H2
2.1.3 InChI Key
INVYSLWXPIEDIQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(C1)C=O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Cyclobutanecarbaldehyde

2. 2987-17-9

3. Chembl18475

4. Mfcd03789631

5. Cyclobutancarbaldehyd

6. Cyclobutanecarboaldehyde

7. 1-cyclobutane-aldehyde

8. Cyclobutane-carbaldehyde

9. 2-cyclobutanecarbaldehyde

10. Cyclobutane Carboxaldehyde

11. Dtxsid70498011

12. Bcp28808

13. Cs-d0314

14. Zinc2511472

15. Bbl100220

16. Bdbm50028845

17. Cyclobutanecarboxaldehyde, Aldrichcpr

18. Stl553793

19. Akos012298721

20. Am90197

21. Sb85395

22. Ps-11985

23. Sy019700

24. Ft-0651605

25. En300-71825

26. 987c179

27. A820088

28. J-520133

2.3 Create Date
2007-02-08
3 Chemical and Physical Properties
Molecular Weight 84.12 g/mol
Molecular Formula C5H8O
XLogP30.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass84.057514874 g/mol
Monoisotopic Mass84.057514874 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count6
Formal Charge0
Complexity55
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

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