Benzoic acid,5-[(1E)-2-[4-[[(2-carboxyethyl)amino]carbonyl]phenyl]diazenyl]-2-hydroxy-,sodium salt, hydrate (1:2:2)


Chemical Name: Benzoic acid,5-[(1E)-2-[4-[[(2-carboxyethyl)amino]carbonyl]phenyl]diazenyl]-2-hydroxy-,sodium salt, hydrate (1:2:2)
CAS Number: 150399-21-6
Product Number: AG00HXSN(AGN-PC-0Q4O0Z)
Synonyms:
MDL No:
Molecular Formula: C17H17N3Na2O8
Molecular Weight: 437.3117

Identification/Properties


Computed Properties
Molecular Weight:
437.316g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
6
Exact Mass:
437.081g/mol
Monoisotopic Mass:
437.081g/mol
Topological Polar Surface Area:
156A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
539
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:
5
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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