Home Boronic acids 3-Amino-5-carboxylphenylboronic acid

3-Amino-5-carboxylphenylboronic acid

CAS No.:
116378-40-6
Catalog Number:
AG000CCG
Molecular Formula:
C7H8BNO4
Molecular Weight:
180.9537
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$138
- +
5g
98%
In Stock USA
United States
$475
- +
10g
98%
In Stock USA
United States
$825
- +
Product Description
Catalog Number:
AG000CCG
Chemical Name:
3-Amino-5-carboxylphenylboronic acid
CAS Number:
116378-40-6
Molecular Formula:
C7H8BNO4
Molecular Weight:
180.9537
MDL Number:
MFCD02179466
IUPAC Name:
3-amino-5-boronobenzoic acid
InChI:
InChI=1S/C7H8BNO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,12-13H,9H2,(H,10,11)
InChI Key:
VVQAAMZMJNXCOP-UHFFFAOYSA-N
SMILES:
Nc1cc(cc(c1)C(=O)O)B(O)O
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.055g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
180.954g/mol
Monoisotopic Mass:
181.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties