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Overview of CAS 916792-10-4

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4CH-012053
PharmaCompass
  • Chemistry
4CH-012053
Also known as: 2-chlorooxazolo[5,4-c]pyridine, 916792-10-4, 2-chloro-[1,3]oxazolo[5,4-c]pyridine, St50824492, Ctk6h4045, Dtxsid10672616
Molecular Formula
C6H3ClN2O
Molecular Weight
154.553  g/mol
InChI Key
CVNMRDXBPVOJFI-UHFFFAOYSA-N

1 2D Structure

4CH-012053

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-chloro-[1,3]oxazolo[5,4-c]pyridine
2.1.2 InChI
InChI=1S/C6H3ClN2O/c7-6-9-4-1-2-8-3-5(4)10-6/h1-3H
2.1.3 InChI Key
CVNMRDXBPVOJFI-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CN=CC2=C1N=C(O2)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 2-chlorooxazolo[5,4-c]pyridine

2. 916792-10-4

3. 2-chloro-[1,3]oxazolo[5,4-c]pyridine

4. St50824492

5. Ctk6h4045

6. Dtxsid10672616

7. 5454ac

8. Anw-56977

9. Mfcd07781161

10. Zinc55045520

11. Oxazolo[5,4-c]pyridine, 2-chloro-

12. Akos016002492

13. Mcule-1005954121

14. 2-chloro-1,3-oxazolo[5,4-c]pyridine

15. Ks-00003t37

16. Ak-89502

17. Ts-02063

18. Aj-112597

19. Kb-230228

20. Tc-145722

21. 4ch-012053

22. St24022189

2.3 Create Date
2010-06-22
3 Chemical and Physical Properties
Molecular Weight 154.553 g/mol
Molecular Formula C6H3ClN2O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass153.993 g/mol
Monoisotopic Mass153.993 g/mol
Topological Polar Surface Area38.9 A^2
Heavy Atom Count10
Formal Charge0
Complexity133
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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