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Home Boronic acids 2-Methoxycarbonylphenylboronic acid

2-Methoxycarbonylphenylboronic acid

CAS No.:
374538-03-1
Catalog Number:
AG003HJY
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$18
- +
5g
97%
In Stock USA
United States
$43
- +
25g
97%
In Stock USA
United States
$147
- +
100g
97%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG003HJY
Chemical Name:
2-Methoxycarbonylphenylboronic acid
CAS Number:
374538-03-1
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
MDL Number:
MFCD02179452
IUPAC Name:
(2-methoxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C8H9BO4/c1-13-8(10)6-4-2-3-5-7(6)9(11)12/h2-5,11-12H,1H3
InChI Key:
ODAXNYMENLFYMY-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1B(O)O
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.966g/mol
Monoisotopic Mass:
180.059g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Palladium(II)-catalyzed annulation of alkynes with ortho-ester-containing phenylboronic acids. Organic letters 20071011
2-(Methoxycarbonyl)phenylboronic acid. Acta crystallographica. Section C, Crystal structure communications 20060501
Properties