N-(2-furylmethyl)-N-[2-(trifluoromethyl)benzyl]amine

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Basic information

CAS: 869952-90-9
Standard SMILES: FC(F)(F)c1ccccc1CNCc1ccco1
InChIKey: OLDURQPCFBLLTL-UHFFFAOYSA-N
Molecular formula: C13H12F3NO
Average molar mass: 255.23 g/mol
Monoisotopic mass: 255.08709849

Names & identifiers

Preferred name: N-(2-furylmethyl)-N-[2-(trifluoromethyl)benzyl]amine
IUPAC: N-(furan-2-ylmethyl)-1-[2-(trifluoromethyl)phenyl]methanamine

Names & synonyms

869952-90-9N-(2-furylmethyl)-N-[2-(trifluoromethyl)benzyl]amineN-[[2-(Trifluoromethyl)phenyl]methyl]-2-furanmethanamine1-(furan-2-yl)-N-[2-(trifluoromethyl)benzyl]methanamineDTXSID601199755N-(furan-2-ylmethyl)-1-[2-(trifluoromethyl)phenyl]methanamineSTK510702AKOS000130546NCGC00327648-01AB01259856-03AN-465/430137011-(Furan-2-yl)-N-{[2-(trifluoromethyl)phenyl]methyl}methanamine

Database identifiers

CAS: 869952-90-9
PubChem CID: 4723213
DTXSID: DTXSID601199755

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 25.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 257

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Compound notes

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