Home Boronic acids 3-Amino-5-(methylcarbamoyl)phenylboronic acid

3-Amino-5-(methylcarbamoyl)phenylboronic acid

CAS No.:
2096335-54-3
Catalog Number:
AG01EHQY
Molecular Formula:
C8H11BN2O3
Molecular Weight:
193.9955
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$375
- +
5g
96%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG01EHQY
Chemical Name:
3-Amino-5-(methylcarbamoyl)phenylboronic acid
CAS Number:
2096335-54-3
Molecular Formula:
C8H11BN2O3
Molecular Weight:
193.9955
MDL Number:
MFCD22192441
IUPAC Name:
[3-amino-5-(methylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C8H11BN2O3/c1-11-8(12)5-2-6(9(13)14)4-7(10)3-5/h2-4,13-14H,10H2,1H3,(H,11,12)
InChI Key:
IPSFYEWECBGHNM-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cc(cc(c1)N)B(O)O
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.086g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
193.997g/mol
Monoisotopic Mass:
194.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties