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Home > Boronic Acids > 848609-02-9
848609-02-9 | Boronic acid, (pentafluorophenyl)-, dimethyl ester
CAS No: 848609-02-9 Catalog No: AG004WNX MDL No:
Product Description
Catalog Number:
AG004WNX
Chemical Name:
Boronic acid, (pentafluorophenyl)-, dimethyl ester
CAS Number:
848609-02-9
Molecular Formula:
C8H6BF5O2
Molecular Weight:
239.9351
IUPAC Name:
dimethoxy-(2,3,4,5,6-pentafluorophenyl)borane
InChI:
InChI=1S/C8H6BF5O2/c1-15-9(16-2)3-4(10)6(12)8(14)7(13)5(3)11/h1-2H3
InChI Key:
YEGQXLCCMJVHGU-UHFFFAOYSA-N
SMILES:
COB(c1c(F)c(F)c(c(c1F)F)F)OC
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.038g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.936g/mol
Monoisotopic Mass:
240.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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