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Home > Boronic Acids > 87199-16-4
87199-16-4 | (3-Formylphenyl)boronic acid
CAS No: 87199-16-4 Catalog No: AG003JI3 MDL No:MFCD00161356
Product Description
Catalog Number:
AG003JI3
Chemical Name:
(3-Formylphenyl)boronic acid
CAS Number:
87199-16-4
Molecular Formula:
C7H7BO3
Molecular Weight:
149.9397
MDL Number:
MFCD00161356
IUPAC Name:
(3-formylphenyl)boronic acid
InChI:
InChI=1S/C7H7BO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-5,10-11H
InChI Key:
HJBGZJMKTOMQRR-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)B(O)O
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.049g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.94g/mol
Monoisotopic Mass:
150.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^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 |
| 3-formylphenylboronic acid. | Acta crystallographica. Section C, Crystal structure communications 20040501 |
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