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CAS 18997-19-8
PharmaCompass
  • Chemistry
CAS 18997-19-8
Also known as: 18997-19-8, Chloromethyl 2,2-dimethylpropanoate, Propanoic acid, 2,2-dimethyl-, chloromethyl ester, Pivalic acid chloromethyl ester, Pivaloyloxymethyl chloride, Pivaloylmethyl chloride
Molecular Formula
C6H11ClO2
Molecular Weight
150.602  g/mol
InChI Key
GGRHYQCXXYLUTL-UHFFFAOYSA-N

1 2D Structure

CAS 18997-19-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
chloromethyl 2,2-dimethylpropanoate
2.1.2 InChI
InChI=1S/C6H11ClO2/c1-6(2,3)5(8)9-4-7/h4H2,1-3H3
2.1.3 InChI Key
GGRHYQCXXYLUTL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)(C)C(=O)OCCl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 18997-19-8

2. Chloromethyl 2,2-dimethylpropanoate

3. Propanoic Acid, 2,2-dimethyl-, Chloromethyl Ester

4. Pivalic Acid Chloromethyl Ester

5. Pivaloyloxymethyl Chloride

6. Pivaloylmethyl Chloride

7. Chloromethyl Trimethylacetate

8. Ggrhyqcxxylutl-uhfffaoysa-n

9. 2,2-dimethylpropionic Acid Chloromethyl Ester

10. Chioromethyl Pivalate

11. Einecs 242-735-1

12. Chloromethyl Pivaloate

13. Chloro-methyl Pivalate

14. Pivaloxymethyl Chloride

15. Pom-cl

16. Pivaloyloxymethylchloride

17. Pivalyloxymethyl Chloride

18. Clch2oc(o)cme3

19. Pivalic Acid Chloromethyl

20. Ac1l3elt

21. Ac1q3vdm

22. Schembl300

23. Chloromethyl Pivalate, 97%

24. Ksc177q8d

25. Tpc-i029

26. Jsp003908

27. Dtxsid1066445

28. Ctk0h7881

29. Ggrhyqcxxylutl-uhfffaoysa-

30. Ks-00000ket

31. Molport-002-501-250

32. Chloromethyl2,2-dimethylpropionate

33. Act05564

34. Chloromethyl 2,2-dimethylpropionate

35. Zinc2242620

36. Anw-23474

37. Mfcd00000884

38. Akos006223678

39. Cs-w018522

40. Ls40448

41. Ne10060

42. Rp21418

43. Rtc-063633

44. Tra0058304

45. Trimethylacetic Acid Chloromethyl Ester

46. Aj-34153

47. Ak155878

48. As-19276

49. Cj-07959

50. Sc-16086

51. Db-029580

52. Tc-063633

53. Tl8001550

54. Ft-0623677

55. P1012

56. St24046316

57. X6284

58. Propanoicacid,2,2-dimethyl-,chloromethylester

59. 2,2-dimethyl-propionic Acid Chloromethyl Ester

60. 2,2-dimethylpropanoic Acid, Chloromethyl Ester

61. 107830-ep2272822a1

62. 107830-ep2286811a1

63. 107830-ep2298746a1

64. 2-dimethylpropionic Acid Chloromethyl Ester

65. Sr-01000944704

66. I14-3099

67. Sr-01000944704-1

68. F0001-0685

69. Inchi=1/c6h11clo2/c1-6(2,3)5(8)9-4-7/h4h2,1-3h3

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 150.602 g/mol
Molecular Formula C6H11ClO2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass150.045 g/mol
Monoisotopic Mass150.045 g/mol
Topological Polar Surface Area26.3 A^2
Heavy Atom Count9
Formal Charge0
Complexity104
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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