Close
4

Overview

Client Email Product
CAS 18776-12-0
PharmaCompass
CAS 18776-12-0
Also known as: 18776-12-0, 3-chloro-1-phenyl-1-propanol, 3-chloro-1-phenylpropanol, 3-chloro-1-phenyl-propanol, 3-chloro-1-phenyl-propan-1-ol, Ak-40050
Molecular Formula
C9H11ClO
Molecular Weight
170.636  g/mol
InChI Key
JZFUHAGLMZWKTF-UHFFFAOYSA-N

1 2D Structure

CAS 18776-12-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-chloro-1-phenylpropan-1-ol
2.1.2 InChI
InChI=1S/C9H11ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2
2.1.3 InChI Key
JZFUHAGLMZWKTF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C(CCCl)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 18776-12-0

2. 3-chloro-1-phenyl-1-propanol

3. 3-chloro-1-phenylpropanol

4. 3-chloro-1-phenyl-propanol

5. 3-chloro-1-phenyl-propan-1-ol

6. Ak-40050

7. R(+)-3-chloro-1-phenylpropanol

8. Pubchem14094

9. Ac1lc9ia

10. Ac1q3uhx

11. Acmc-2097ok

12. Acmc-2097ol

13. Ksc497i3f

14. Schembl525669

15. Rac 3-chloro-1-phenylpropanol

16. 1-phenyl-3-chloro-1-propanol

17. Ctk3j7432

18. Dtxsid80341286

19. Jzfuhaglmzwktf-uhfffaoysa-n

20. Molport-003-698-666

21. Act09179

22. Albb-004119

23. Jfd00621

24. Zx-an004088

25. Alpha-(2-chloroethyl)benzyl Alcohol

26. Anw-50154

27. Fch831805

28. Mfcd09878800

29. Sbb047159

30. Stk502931

31. (-)-3-chloro-1-phenyl-1-propanol

32. Akos000321631

33. Akos016342130

34. Racemic 3-chloro-1-phenyl-1-propanol

35. An-9827

36. Cs-w019837

37. Rtr-033416

38. Tra0004700

39. Tra0034997

40. (r )-(+)-3-chloro-1-phenylpropanol

41. Acm18776120

42. Ks-0000090x

43. Br-40050

44. Ds-13210

45. Kb-95970

46. Or002313

47. Sc-00015

48. Sc-47390

49. Ab0005567

50. Ax8085546

51. Kb-181402

52. Kb-181404

53. St2410598

54. Tr-033416

55. 4ch-007016

56. 4ch-015521

57. Bb 0240838

58. Ft-0664923

59. W4052

60. A16167

61. A23534

62. En300-154529

63. S-1828

64. 776c120

65. I01-0851

66. J-012087

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 170.636 g/mol
Molecular Formula C9H11ClO
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass170.05 g/mol
Monoisotopic Mass170.05 g/mol
Topological Polar Surface Area20.2 A^2
Heavy Atom Count11
Formal Charge0
Complexity99.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty

Advertise With Us

Advertise With Us