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Technical details about CAS IN2763647, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 42330-59-6, (2-chloro-3-pyridinyl)methanol, 2-chloro-3-pyridinylmethanol, 2-chloro-3-pyridinemethanol, 2-chloro-3-(hydroxymethyl)pyridine, 2-chloro-3-pyridinyl methanol
Molecular Formula
C6H6ClNO
Molecular Weight
143.57  g/mol
InChI Key
HMPDWSBKPCOQDW-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2-chloropyridin-3-yl)methanol
2.1.2 InChI
InChI=1S/C6H6ClNO/c7-6-5(4-9)2-1-3-8-6/h1-3,9H,4H2
2.1.3 InChI Key
HMPDWSBKPCOQDW-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(N=C1)Cl)CO
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 42330-59-6

2. (2-chloro-3-pyridinyl)methanol

3. 2-chloro-3-pyridinylmethanol

4. 2-chloro-3-pyridinemethanol

5. 2-chloro-3-(hydroxymethyl)pyridine

6. 2-chloro-3-pyridinyl Methanol

7. (2-chloro-pyridin-3-yl)-methanol

8. Mfcd01935961

9. 2-chloro-3-hydroxymethylpyridine

10. (2-chloro-3-pyridyl)methanol

11. 2-chloropyridine-3-methanol

12. Schembl580627

13. (2-chloropyridin -3-yl)methanol

14. Dtxsid90377071

15. Hmpdwsbkpcoqdw-uhfffaoysa-n

16. 2-chloro-3-pyridylmethanol

17. Cs-d0980

18. 1-(2-chloro-pyridin-3-yl)methanol

19. 2-chloro-3-(hydroxymethyl)-pyridine

20. Cl0067

21. Akos005070072

22. 2l-375s

23. Ac-2919

24. Pb27555

25. Ncgc00322572-01

26. Sy003338

27. (2-chloro-3-pyridinyl)methanol, Aldrichcpr

28. Am20070280

29. C2590

30. Ft-0650466

31. En300-62117

32. Ab01318162-02

33. J-500722

34. Z979431808

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 143.57 g/mol
Molecular Formula C6H6ClNO
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area33.1
Heavy Atom Count9
Formal Charge0
Complexity89.1
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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