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Home > Boronic Acids > 1072951-90-6
1072951-90-6 | (6-Bromo-2-fluoro-3-iodophenyl)boronic acid
CAS No: 1072951-90-6 Catalog No: AG003N3T MDL No:MFCD09038418
Product Description
Catalog Number:
AG003N3T
Chemical Name:
(6-Bromo-2-fluoro-3-iodophenyl)boronic acid
CAS Number:
1072951-90-6
Molecular Formula:
C6H4BBrFIO2
Molecular Weight:
344.7126
MDL Number:
MFCD09038418
IUPAC Name:
(6-bromo-2-fluoro-3-iodophenyl)boronic acid
InChI:
InChI=1S/C6H4BBrFIO2/c8-3-1-2-4(10)6(9)5(3)7(11)12/h1-2,11-12H
InChI Key:
OZLRLKXUEMIENO-UHFFFAOYSA-N
SMILES:
OB(c1c(Br)ccc(c1F)I)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.852g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
344.713g/mol
Monoisotopic Mass:
343.852g/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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