1H-Pyrrole-2-carboxylic acid, 4-bromo-


Chemical Name: 1H-Pyrrole-2-carboxylic acid, 4-bromo-
CAS Number: 27746-02-7
Product Number: AG002UNC(AGN-PC-0KKBA7)
Synonyms:
MDL No:
Molecular Formula: C5H4BrNO2
Molecular Weight: 189.9948

Identification/Properties


Computed Properties
Molecular Weight:
189.996g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
188.943g/mol
Monoisotopic Mass:
188.943g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
128
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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