Home Boronic acids 4-Carboxy-2-methylphenylboronic acid

4-Carboxy-2-methylphenylboronic acid

CAS No.:
158429-66-4
Catalog Number:
AG001Q6Z
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$125
- +
1g
97%
In Stock USA
United States
$285
- +
Product Description
Catalog Number:
AG001Q6Z
Chemical Name:
4-Carboxy-2-methylphenylboronic acid
CAS Number:
158429-66-4
Molecular Formula:
C8H9BO4
Molecular Weight:
179.9657
MDL Number:
MFCD09037833
IUPAC Name:
4-borono-3-methylbenzoic acid
InChI:
InChI=1S/C8H9BO4/c1-5-4-6(8(10)11)2-3-7(5)9(12)13/h2-4,12-13H,1H3,(H,10,11)
InChI Key:
QIGSMEYLQVLGRY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)C)B(O)O
Properties
Complexity:
195  
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:
3  
Isotope Atom Count:
0
Molecular Weight:
179.966g/mol
Monoisotopic Mass:
180.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties