Home Boronic acids 2-Carboxy-4,5-dimethoxyphenylboronic acid

2-Carboxy-4,5-dimethoxyphenylboronic acid

CAS No.:
1256345-91-1
Catalog Number:
AG000O0O
Molecular Formula:
C9H11BO6
Molecular Weight:
225.9910
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
96%
In Stock USA
United States
$94
- +
250mg
96%
In Stock USA
United States
$185
- +
Product Description
Catalog Number:
AG000O0O
Chemical Name:
2-Carboxy-4,5-dimethoxyphenylboronic acid
CAS Number:
1256345-91-1
Molecular Formula:
C9H11BO6
Molecular Weight:
225.9910
MDL Number:
MFCD17015736
IUPAC Name:
2-borono-4,5-dimethoxybenzoic acid
InChI:
InChI=1S/C9H11BO6/c1-15-7-3-5(9(11)12)6(10(13)14)4-8(7)16-2/h3-4,13-14H,1-2H3,(H,11,12)
InChI Key:
WDKCKAPUQPJHJV-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)O)c(cc1OC)B(O)O
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.065g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
225.991g/mol
Monoisotopic Mass:
226.065g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties