2-(2,6-dimethylmorpholin-4-yl)-5-nitrobenzoic acid


Chemical Name: 2-(2,6-dimethylmorpholin-4-yl)-5-nitrobenzoic acid
CAS Number: 175136-71-7
Product Number: AG00209G(AGN-PC-04C5Q2)
Synonyms:
MDL No:
Molecular Formula: C13H16N2O5
Molecular Weight: 280.2765

Identification/Properties


Computed Properties
Molecular Weight:
280.28g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
280.106g/mol
Monoisotopic Mass:
280.106g/mol
Topological Polar Surface Area:
95.6A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
373
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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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