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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

CAS 5006-22-4
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

BUILDING BLOCK

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