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Home > Boronic Acids > 1008106-86-2
1008106-86-2 | Boronic acid, B-(2-iodophenyl)-
CAS No: 1008106-86-2 Catalog No: AG0002XU MDL No:MFCD09743934
Product Description
Catalog Number:
AG0002XU
Chemical Name:
Boronic acid, B-(2-iodophenyl)-
CAS Number:
1008106-86-2
Molecular Formula:
C6H6BIO2
Molecular Weight:
247.8261
MDL Number:
MFCD09743934
IUPAC Name:
(2-iodophenyl)boronic acid
InChI:
InChI=1S/C6H6BIO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4,9-10H
InChI Key:
MGUDXXNWLVGZIF-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1I)O
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.951g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.826g/mol
Monoisotopic Mass:
247.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Direct amidation of carboxylic acids catalyzed by ortho-iodo arylboronic acids: catalyst optimization, scope, and preliminary mechanistic study supporting a peculiar halogen acceleration effect. | The Journal of organic chemistry 20121005 |
| Preparation and X-ray crystal study of benziodoxaborole derivatives: new hypervalent iodine heterocycles. | Inorganic chemistry 20111107 |
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