Home Halogens 5-bromo-2-(carbamoylamino)benzoic acid

5-bromo-2-(carbamoylamino)benzoic acid

CAS No.:
861791-79-9
Catalog Number:
AG01AIIB
Molecular Formula:
C8H7BrN2O3
Molecular Weight:
259.0568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AIIB
Chemical Name:
5-bromo-2-(carbamoylamino)benzoic acid
CAS Number:
861791-79-9
Molecular Formula:
C8H7BrN2O3
Molecular Weight:
259.0568
MDL Number:
MFCD16666288
IUPAC Name:
5-bromo-2-(carbamoylamino)benzoic acid
InChI:
InChI=1S/C8H7BrN2O3/c9-4-1-2-6(11-8(10)14)5(3-4)7(12)13/h1-3H,(H,12,13)(H3,10,11,14)
InChI Key:
GDBBPPGNIRGLGX-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1ccc(cc1C(=O)O)Br
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.964g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
259.059g/mol
Monoisotopic Mass:
257.964g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties