1H-Pyrrole-2-carboxaldehyde, 4-(4-fluorobenzoyl)-1-methyl-


Chemical Name: 1H-Pyrrole-2-carboxaldehyde, 4-(4-fluorobenzoyl)-1-methyl-
CAS Number: 128843-61-8
Product Number: AG000YES(AGN-PC-0KKW56)
Synonyms:
MDL No:
Molecular Formula: C13H10FNO2
Molecular Weight: 231.2224

Identification/Properties


Computed Properties
Molecular Weight:
231.226g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
231.07g/mol
Monoisotopic Mass:
231.07g/mol
Topological Polar Surface Area:
39.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
300
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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