2H-Isoindole-2-acetic acid, 1,3-dihydro-1,3-dioxo-a-(phenylmethyl)-,(aS)-


Chemical Name: 2H-Isoindole-2-acetic acid, 1,3-dihydro-1,3-dioxo-a-(phenylmethyl)-,(aS)-
CAS Number: 5123-55-7
Product Number: AG00I96B(AGN-PC-0SA25E)
Synonyms:
MDL No:
Molecular Formula: C17H13NO4
Molecular Weight: 295.2894

Identification/Properties


Computed Properties
Molecular Weight:
295.294g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
295.084g/mol
Monoisotopic Mass:
295.084g/mol
Topological Polar Surface Area:
74.7A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
445
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


NMR Spectrum


Other Analytical Data


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