1H-Pyrrole-2,5-dicarboxylic acid, 3,4-dihydroxy-1-(phenylmethyl)-,dimethyl ester


Chemical Name: 1H-Pyrrole-2,5-dicarboxylic acid, 3,4-dihydroxy-1-(phenylmethyl)-,dimethyl ester
CAS Number: 148528-45-4
Product Number: AG001KZX(AGN-PC-0Q1YM5)
Synonyms:
MDL No:
Molecular Formula: C15H15NO6
Molecular Weight: 305.2827

Identification/Properties


Computed Properties
Molecular Weight:
305.286g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
305.09g/mol
Monoisotopic Mass:
305.09g/mol
Topological Polar Surface Area:
98A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
381
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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