1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

potassium;trifluoro-(2-fluoro-6-hydroxyphenyl)boranuide

2.1.2 InChI

InChI=1S/C6H4BF4O.K/c8-4-2-1-3-5(12)6(4)7(9,10)11;/h1-3,12H;/q-1;+1

2.1.3 InChI Key

KDSFFRRHNBFXRQ-UHFFFAOYSA-N

2.2 Synonyms

2.2.1 MeSH Synonyms

1. (none)

2.2.2 Depositor-Supplied Synonyms

1. 2252415-10-2

2. Mfcd32068467

3. Potassium Trifluoro(2-fluoro-6-hydroxyphenyl)boranuide

4. Potassium;trifluoro-(2-fluoro-6-hydroxyphenyl)boranuide

5. Borate(1-), Trifluoro(2-fluoro-6-hydroxyphenyl)-, Potassium (1:1)

6. C6h4bf4ko

7. Potassium;trifluoro-(2-fluoro-6-hydroxy-phenyl)boranuide

8. Schembl20560337

9. Schembl29728081

10. Ac9226

11. Sy253836

12. Db-404329

13. Cs-0169452

14. Potassium Trifluoro(2-fluoro-6-hydroxyphenyl)borate, 95%

15. Borate(1-),trifluoro(2-fluoro-6-hydroxyphenyl)-,potassium(1:1)

2.3 Create Date

2019-09-30

3 Chemical and Physical Properties

Molecular Formula	C₆H₄BF₄KO
Molecular Weight	218.00 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	20.2
Heavy Atom Count	13
Formal Charge	0
Complexity	165
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

CAS 2252415-10-2