Organofluorine / Alfa Chemistry
4-Fluoro-5-iodo-1H-indole

4-Fluoro-5-iodo-1H-indole

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4-Fluoro-5-iodo-1H-indole
Catalog OFC1240113409
CAS 1240113-40-9
Category Fluorinated Indoles
Synonyms 1H-Indole, 4-fluoro-5-iodo-
MDL Number MFCD22628143
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 4-fluoro-5-iodo-1H-indole
InChI InChI=1S/C8H5FIN/c9-8-5-3-4-11-7(5)2-1-6(8)10/h1-4,11H
InChI Key CBYZOJLRQMRDKN-UHFFFAOYSA-N
Isomeric SMILES C1=CC(=C(C2=C1NC=C2)F)I
Molecular Formula C8H5FIN
Molecular Weight 261.03
XLogP3-AA 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 260.94507 g/mol
Monoisotopic Mass 260.94507 g/mol
Topological Polar Surface Area 15.8Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 153

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