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CAS 5006-22-4 manufacturers and suppliers on PharmaCompass

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CAS 5006-22-4
Also known as: 5006-22-4, Cyclobutanecarboxylic acid chloride, Cyclobutanecarbonylchloride, Cyclobutylcarbonyl chloride, Cyclobutylcarboxylic acid chloride, Cyclobutane-1-carbonyl chloride
Molecular Formula
C5H7ClO
Molecular Weight
118.56  g/mol
InChI Key
JFWMYCVMQSLLOO-UHFFFAOYSA-N

1 2D Structure

CAS 5006-22-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
cyclobutanecarbonyl chloride
2.1.2 InChI
InChI=1S/C5H7ClO/c6-5(7)4-2-1-3-4/h4H,1-3H2
2.1.3 InChI Key
JFWMYCVMQSLLOO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(C1)C(=O)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 5006-22-4

2. Cyclobutanecarboxylic Acid Chloride

3. Cyclobutanecarbonylchloride

4. Cyclobutylcarbonyl Chloride

5. Cyclobutylcarboxylic Acid Chloride

6. Cyclobutane-1-carbonyl Chloride

7. Einecs 225-680-8

8. Cyclobutanoyl Chloride

9. Cyclobutylcarbonylchloride

10. Cyclobutancarbonyl Chloride

11. Cyclobutyl Carbonylchloride

12. Cyclobutyl Carbonyl Chloride

13. Cyclobutane Carbonyl Chloride

14. Cyclobutane-carbonyl Chloride

15. Cyclobutane Carboxyl Chloride

16. Cyclobutanecarboxylic Chloride

17. Schembl126540

18. Dtxsid40198197

19. Cyclobutanecarbonyl Chloride, 98%

20. Cyclobutyl Carboxylic Acid Chloride

21. Albb-032816

22. Cyclobutane Carboxylic Acid Chloride

23. Cyclobutanecarboxylic Acid, Chloride

24. Nsc93778

25. Str05510

26. Zinc1609476

27. Mfcd00001319

28. Nsc 93778

29. Nsc-93778

30. Akos009156527

31. Bp-20175

32. Db-013331

33. Ft-0624148

34. D87747

35. W-105991

36. F2190-0158

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 118.56 g/mol
Molecular Formula C5H7ClO
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass118.0185425 g/mol
Monoisotopic Mass118.0185425 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count7
Formal Charge0
Complexity86.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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