Organofluorine / Alfa Chemistry
5-(Trifluoromethyl)-1H-indole-3-carbaldehyde

5-(Trifluoromethyl)-1H-indole-3-carbaldehyde

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5-(Trifluoromethyl)-1H-indole-3-carbaldehyde
Catalog OFC468718163
CAS 468718-16-3
Category Fluorinated Aldehydes
Purity 97%
MDL Number MFCD09954785
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 5-(trifluoromethyl)-1H-indole-3-carbaldehyde
InChI InChI=1S/C10H6F3NO/c11-10(12,13)7-1-2-9-8(3-7)6(5-15)4-14-9/h1-5,14H
InChI Key ABXIESRZLRQYLM-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C=C1C(F)(F)F)C(=CN2)C=O
Molecular Formula C10H6F3NO
Molecular Weight 213.16
Storage Keep in dark place, inert atmosphere, room temperature
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 213.04014830 g/mol
Monoisotopic Mass 213.04014830 g/mol
Topological Polar Surface Area 32.9Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 264

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