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Technical details about CAS 25026-34-0, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 25026-34-0, 2-(4-chlorophenyl)acetyl chloride, P-chlorophenylacetyl chloride, 4-chlorobenzeneacetyl chloride, Benzeneacetyl chloride, 4-chloro-, 4-chlorobenzeneacetylchloride
Molecular Formula
C8H6Cl2O
Molecular Weight
189.04  g/mol
InChI Key
UMQUIRYNOVNYPA-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(4-chlorophenyl)acetyl chloride
2.1.2 InChI
InChI=1S/C8H6Cl2O/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2
2.1.3 InChI Key
UMQUIRYNOVNYPA-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1CC(=O)Cl)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 25026-34-0

2. 2-(4-chlorophenyl)acetyl Chloride

3. P-chlorophenylacetyl Chloride

4. 4-chlorobenzeneacetyl Chloride

5. Benzeneacetyl Chloride, 4-chloro-

6. 4-chlorobenzeneacetylchloride

7. (4-chlorophenyl)acetyl Chloride

8. 4-chlorophenylacetic Acid Chloride

9. Einecs 246-571-1

10. Mfcd00037111

11. 4-chlorophenylacetylchloride

12. 4-chlorobenzenacetyl Chloride

13. Schembl76050

14. P-chlorophenyl-acetyl Chloride

15. (4-chlorophenyl)acetylchloride

16. 4-chloro-phenylacetyl Chloride

17. 4-chlorophenyl Acetyl Chloride

18. 4-chlorophenyl-acetyl Chloride

19. 4-chloro Phenyl Acetyl Chloride

20. (4-chlorophenyl)-acetyl Chloride

21. 2-(4-chlorophenyl)acetylchloride

22. Dtxsid10179736

23. (4-chloro-phenyl)-acetyl Chloride

24. 4-chlorobenzeneacetic Acid Chloride

25. Act03055

26. Zinc2168258

27. 4-chlorophenylacetyl Chloride, 97%

28. Akos001322484

29. Amy202100060

30. As-54507

31. Db-046606

32. Ft-0618249

33. S10930

34. 026c340

35. W-107269

36. F2190-0111

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 189.04 g/mol
Molecular Formula C8H6Cl2O
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass187.9795702 g/mol
Monoisotopic Mass187.9795702 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity139
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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