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Also known as: 5-fluoro-3-iodo-1h-pyrazolo[3,4-b]pyridine, 1350653-23-4, 5-fluoro-3-iodo-2h-pyrazolo[3,4-b]pyridine, 1h-pyrazolo[3,4-b]pyridine, 5-fluoro-3-iodo-, Mfcd20923264, Bn7nzv7hcm
Molecular Formula
C6H3FIN3
Molecular Weight
263.01  g/mol
InChI Key
HSJHOTUQSLQXLL-UHFFFAOYSA-N
FDA UNII
BN7NZV7HCM

CAS 1350653-23-4
1 2D Structure

CAS 1350653-23-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-fluoro-3-iodo-2H-pyrazolo[3,4-b]pyridine
2.1.2 InChI
InChI=1S/C6H3FIN3/c7-3-1-4-5(8)10-11-6(4)9-2-3/h1-2H,(H,9,10,11)
2.1.3 InChI Key
HSJHOTUQSLQXLL-UHFFFAOYSA-N
2.2 Other Identifiers
2.2.1 UNII
BN7NZV7HCM
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 5-fluoro-3-iodo-1h-pyrazolo[3,4-b]pyridine

2. 1350653-23-4

3. 5-fluoro-3-iodo-2h-pyrazolo[3,4-b]pyridine

4. 1h-pyrazolo[3,4-b]pyridine, 5-fluoro-3-iodo-

5. Mfcd20923264

6. Bn7nzv7hcm

7. C6h3fin3

8. Schembl174737

9. Dtxsid60735442

10. Hsjhotuqslqxll-uhfffaoysa-n

11. Pb21538

12. 5-fluoro-3-iodopyrazolo[3,4-b]pyridine

13. As-82414

14. Sy098167

15. Db-185795

16. Cs-0054360

17. 5-fluoro-3-iod-1h-pyrazolo[3,4-b]pyridine

2.4 Create Date
2012-11-30
3 Chemical and Physical Properties
Molecular Weight 263.01 g/mol
Molecular Formula C6H3FIN3
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area41.6
Heavy Atom Count11
Formal Charge0
Complexity157
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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