Benzoic acid, 3,5-diamino-2-hydroxy-


Chemical Name: Benzoic acid, 3,5-diamino-2-hydroxy-
CAS Number: 112725-89-0
Product Number: AG007SDT(AGN-PC-0NKXBG)
Synonyms:
MDL No:
Molecular Formula: C7H8N2O3
Molecular Weight: 168.1500

Identification/Properties


Computed Properties
Molecular Weight:
168.152g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
168.053g/mol
Monoisotopic Mass:
168.053g/mol
Topological Polar Surface Area:
110A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
186
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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