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Home > Boronic Acids > 849062-35-7
849062-35-7 | Boronic acid,B-(2-bromo-3,4,5,6-tetrafluorophenyl)-
CAS No: 849062-35-7 Catalog No: AG004PUN MDL No:
Product Description
Catalog Number:
AG004PUN
Chemical Name:
Boronic acid,B-(2-bromo-3,4,5,6-tetrafluorophenyl)-
CAS Number:
849062-35-7
Molecular Formula:
C6H2BBrF4O2
Molecular Weight:
272.7875
IUPAC Name:
(2-bromo-3,4,5,6-tetrafluorophenyl)boronic acid
InChI:
InChI=1S/C6H2BBrF4O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h13-14H
InChI Key:
SNFARXZQGCXAEZ-UHFFFAOYSA-N
SMILES:
OB(c1c(F)c(F)c(c(c1Br)F)F)O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.927g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.788g/mol
Monoisotopic Mass:
271.927g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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