1H-Pyrrole-1-carboxylic acid, 3,4-dibromo-2,5-dihydro-2,5-dioxo-, methyl ester


Chemical Name: 1H-Pyrrole-1-carboxylic acid, 3,4-dibromo-2,5-dihydro-2,5-dioxo-, methyl ester
CAS Number: 1442447-48-4
Product Number: AG001J5R(AGN-PC-0WB007)
Synonyms:
MDL No:
Molecular Formula: C6H3Br2NO4
Molecular Weight: 312.9003

Identification/Properties


Computed Properties
Molecular Weight:
312.901g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
312.841g/mol
Monoisotopic Mass:
310.843g/mol
Topological Polar Surface Area:
63.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
312
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

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NMR Spectrum


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