3-(5-chloro-2-hydroxy-3-nitrophenyl)benzoic acid


Chemical Name: 3-(5-chloro-2-hydroxy-3-nitrophenyl)benzoic acid
CAS Number: 376592-58-4
Product Number: AG0078EO(AGN-PC-035ENM)
Synonyms:
MDL No:
Molecular Formula: C13H8ClNO5
Molecular Weight: 293.6593

Identification/Properties


Computed Properties
Molecular Weight:
293.659g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
293.009g/mol
Monoisotopic Mass:
293.009g/mol
Topological Polar Surface Area:
103A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
385
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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