3-amino-4-phenoxybenzoic acid


Chemical Name: 3-amino-4-phenoxybenzoic acid
CAS Number: 37531-32-1
Product Number: AG0079IL(AGN-PC-02U1GI)
Synonyms:
MDL No:
Molecular Formula: C13H11NO3
Molecular Weight: 229.2313

Identification/Properties


Computed Properties
Molecular Weight:
229.235g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
229.074g/mol
Monoisotopic Mass:
229.074g/mol
Topological Polar Surface Area:
72.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
263
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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