1H-Pyrrole-2-carboxylic acid, 3-amino-4-chloro-1-methyl-, ethyl ester


Chemical Name: 1H-Pyrrole-2-carboxylic acid, 3-amino-4-chloro-1-methyl-, ethyl ester
CAS Number: 100158-71-2
Product Number: AG01BCZW(AGN-PC-00N54D)
Synonyms:
MDL No:
Molecular Formula: C8H11ClN2O2
Molecular Weight: 202.6381

Identification/Properties


Computed Properties
Molecular Weight:
202.638g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
202.051g/mol
Monoisotopic Mass:
202.051g/mol
Topological Polar Surface Area:
57.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
201
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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