1,3-Benzenedicarboxylic acid, 4-nitro-, dimethyl ester


Chemical Name: 1,3-Benzenedicarboxylic acid, 4-nitro-, dimethyl ester
CAS Number: 69048-70-0
Product Number: AG003PLI(AGN-PC-0NJAHT)
Synonyms:
MDL No: MFCD00177948
Molecular Formula: C10H9NO6
Molecular Weight: 239.1816

Identification/Properties


Properties
MP:
77-80℃
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
239.183g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
239.043g/mol
Monoisotopic Mass:
239.043g/mol
Topological Polar Surface Area:
98.4A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
323
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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