Home Boronic acids 3-Amino-5-carbamoylphenylboronic acid

3-Amino-5-carbamoylphenylboronic acid

CAS No.:
1801408-17-2
Catalog Number:
AG00I00F
Molecular Formula:
C7H9BN2O3
Molecular Weight:
179.9690
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$163
- +
1g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG00I00F
Chemical Name:
3-Amino-5-carbamoylphenylboronic acid
CAS Number:
1801408-17-2
Molecular Formula:
C7H9BN2O3
Molecular Weight:
179.9690
MDL Number:
MFCD22192442
IUPAC Name:
(3-amino-5-carbamoylphenyl)boronic acid
InChI:
InChI=1S/C7H9BN2O3/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,12-13H,9H2,(H2,10,11)
InChI Key:
SGUFPLUNZOZMTQ-UHFFFAOYSA-N
SMILES:
Nc1cc(cc(c1)C(=O)N)B(O)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.071g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
179.97g/mol
Monoisotopic Mass:
180.071g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties