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Also known as: 90-99-3, Benzhydryl chloride, (chloromethylene)dibenzene, Diphenylchloromethane, Benzene, 1,1'-(chloromethylene)bis-, Diphenylmethyl chloride
Molecular Formula
C13H11Cl
Molecular Weight
202.68  g/mol
InChI Key
ZDVDCDLBOLSVGM-UHFFFAOYSA-N
FDA UNII
CN9N9AYV4B

CAS 90-99-3
1 2D Structure

CAS 90-99-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[chloro(phenyl)methyl]benzene
2.1.2 InChI
InChI=1S/C13H11Cl/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
2.1.3 InChI Key
ZDVDCDLBOLSVGM-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl
2.2 Other Identifiers
2.2.1 UNII
CN9N9AYV4B
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 90-99-3

2. Benzhydryl Chloride

3. (chloromethylene)dibenzene

4. Diphenylchloromethane

5. Benzene, 1,1'-(chloromethylene)bis-

6. Diphenylmethyl Chloride

7. Methane, Chlorodiphenyl-

8. Chloro(diphenyl)methane

9. [chloro(phenyl)methyl]benzene

10. 1,1'-(chloromethylene)bisbenzene

11. Benzhydrylchloride

12. Cn9n9ayv4b

13. Mfcd00000855

14. Nsc-76584

15. Alpha-chloroditan

16. Unii-cn9n9ayv4b

17. Hsdb 2804

18. Benzhydryl-chloride

19. Einecs 202-031-7

20. Diphenylmethylchloride

21. Nsc 76584

22. Diphenymethyl Chloride

23. Diphenylchloromethane;

24. Diphenyl Methylchloride

25. A-chlorodiphenylmethane

26. Chloro-diphenyl-methane

27. Ai3-11230

28. 1,1-diphenylchloromethane

29. Alpha-chlorodiphenylmethane

30. .alpha.-chloroditan

31. Chlorodiphenylmethane, 98%

32. 1,1-diphenylmethyl Chloride

33. Schembl151375

34. 1-chloro-1,1-diphenylmethane

35. 1-chloro-1, 1-diphenylmethane

36. [chloro(phenyl)methyl]benzene #

37. Dtxsid10861684

38. Benzene,1'-(chloromethylene)bis-

39. Act03286

40. Chlorodiphenylmethane [hsdb]

41. Nsc76584

42. Zinc1707955

43. .alpha.-chlorodiphenylmethane

44. 1,1'-(chloromethylene)bis(benzene)

45. Akos000120659

46. Cs-w015490

47. N-(4-fluorophenyl)anthranilicacid

48. As-11942

49. Db-057236

50. Am20041357

51. Ft-0622661

52. D70178

53. Q-200687

54. Q27275553

55. F0001-2208

56. Benzhydryl Chloride, Polymer-bound, 100-200 Mesh, Extent Of Labeling: 1.6-2.2 Mmol/g Loading, 1 % Cross-linked With Divinylbenzene

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 202.68 g/mol
Molecular Formula C13H11Cl
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass202.0549280 g/mol
Monoisotopic Mass202.0549280 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity137
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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