5-(2-Fluorophenyl)-1H-pyrrole-3-carbonitrile


Chemical Name: 5-(2-Fluorophenyl)-1H-pyrrole-3-carbonitrile
CAS Number: 1240948-77-9
Product Number: AG000LJV(AGN-PC-0WAMH5)
Synonyms:
MDL No: MFCD24619247
Molecular Formula: C11H7FN2
Molecular Weight: 186.1851

Identification/Properties


Computed Properties
Molecular Weight:
186.189g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
186.059g/mol
Monoisotopic Mass:
186.059g/mol
Topological Polar Surface Area:
39.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
245
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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