Benzeneacetic acid, 3-nitro-, ethyl ester


Chemical Name: Benzeneacetic acid, 3-nitro-, ethyl ester
CAS Number: 14318-64-0
Product Number: AG009GDI(AGN-PC-0039ZW)
Synonyms:
MDL No: MFCD09953138
Molecular Formula: C10H11NO4
Molecular Weight: 209.1986

Identification/Properties


Computed Properties
Molecular Weight:
209.201g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
209.069g/mol
Monoisotopic Mass:
209.069g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
236
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


NMR Spectrum


Other Analytical Data


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