Organofluorine / Alfa Chemistry
5-Fluoro-2-(1H-pyrazol-3-yl)-1H-indole

5-Fluoro-2-(1H-pyrazol-3-yl)-1H-indole

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5-Fluoro-2-(1H-pyrazol-3-yl)-1H-indole
Catalog OFC827317237
CAS 827317-23-7
Category Fluorinated Indoles
Synonyms 2-(1,2-Dihydro-3H-pyrazol-3-ylidene)-5-fluoro-2H-indole
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 5-fluoro-2-(1H-pyrazol-5-yl)-1H-indole
InChI InChI=1S/C11H8FN3/c12-8-1-2-9-7(5-8)6-11(14-9)10-3-4-13-15-10/h1-6,14H,(H,13,15)
InChI Key PQUCXQUNCLTUAJ-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C=C1F)C=C(N2)C3=CC=NN3
Molecular Formula C11H8FN3
Molecular Weight 201.20
XLogP3-AA 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 201.07022543 g/mol
Monoisotopic Mass 201.07022543 g/mol
Topological Polar Surface Area 44.5Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 236

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