Organofluorine / Alfa Chemistry
(5-Fluoro-1H-indol-1-yl)(2-methoxyphenyl)methanone

(5-Fluoro-1H-indol-1-yl)(2-methoxyphenyl)methanone

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(5-Fluoro-1H-indol-1-yl)(2-methoxyphenyl)methanone
Catalog OFC820234239
CAS 820234-23-9
Category Fluorinated Indoles
Synonyms (2-Methoxyphenyl)(5-fluoro-1H-indole-1-yl) ketone
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name (5-fluoroindol-1-yl)-(2-methoxyphenyl)methanone
InChI InChI=1S/C16H12FNO2/c1-20-15-5-3-2-4-13(15)16(19)18-9-8-11-10-12(17)6-7-14(11)18/h2-10H,1H3
InChI Key NHBXRXXPFAKVLN-UHFFFAOYSA-N
Isomeric SMILES COC1=CC=CC=C1C(=O)N2C=CC3=C2C=CC(=C3)F
Molecular Formula C16H12FNO2
Molecular Weight 269.27
XLogP3-AA 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 269.08520679 g/mol
Monoisotopic Mass 269.08520679 g/mol
Topological Polar Surface Area 31.2Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 362

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