Home Boronic acids 3-(Methoxycarbonyl)-5-methylphenylboronic acid

3-(Methoxycarbonyl)-5-methylphenylboronic acid

CAS No.:
929626-18-6
Catalog Number:
AG00H32C
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$188
- +
1g
98%
In Stock USA
United States
$400
- +
5g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00H32C
Chemical Name:
3-(Methoxycarbonyl)-5-methylphenylboronic acid
CAS Number:
929626-18-6
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
MDL Number:
MFCD09751432
IUPAC Name:
(3-methoxycarbonyl-5-methylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO4/c1-6-3-7(9(11)14-2)5-8(4-6)10(12)13/h3-5,12-13H,1-2H3
InChI Key:
NXVIETJDAUYFAD-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(cc(c1)C)B(O)O
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.993g/mol
Monoisotopic Mass:
194.075g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties