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Home > Boronic Acids > 3900-89-8
3900-89-8 | 2-Chlorophenylboronic Acid
CAS No: 3900-89-8 Catalog No: AG00339K MDL No:MFCD00674012
Product Description
Catalog Number:
AG00339K
Chemical Name:
2-Chlorophenylboronic Acid
CAS Number:
3900-89-8
Molecular Formula:
C6H6BClO2
Molecular Weight:
156.3746
MDL Number:
MFCD00674012
IUPAC Name:
(2-chlorophenyl)boronic acid
InChI:
InChI=1S/C6H6BClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4,9-10H
InChI Key:
RRCMGJCFMJBHQC-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1Cl)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:
156.015g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
156.372g/mol
Monoisotopic Mass:
156.015g/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 |
|---|---|
| Metal-free carbon-carbon bond-forming reductive coupling between boronic acids and tosylhydrazones. | Nature chemistry 20090901 |
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