Octanoic acid, 8-oxo-8-(phenylamino)-


Chemical Name: Octanoic acid, 8-oxo-8-(phenylamino)-
CAS Number: 149648-52-2
Product Number: AG001LWE(AGN-PC-07Y4W7)
Synonyms:
MDL No:
Molecular Formula: C14H19NO3
Molecular Weight: 249.3056

Identification/Properties


Computed Properties
Molecular Weight:
249.31g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
249.136g/mol
Monoisotopic Mass:
249.136g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
260
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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