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[2-(3,4-dimethoxyphenyl)ethyl]({[5-(2-fluorophenyl)furan-2-yl]methyl})amine

[2-(3,4-dimethoxyphenyl)ethyl]({[5-(2-fluorophenyl)furan-2-yl]methyl})amine

Formula: C21H22FNO3

SMILES: COC1=CC=C(CCNCC2=CC=C(O2)C2=CC=CC=C2F)C=C1OC

IUPAC: [2-(3,4-dimethoxyphenyl)ethyl]({[5-(2-fluorophenyl)furan-2-yl]methyl})amine

InChI: InChI=1S/C21H22FNO3/c1-24-20-9-7-15(13-21(20)25-2)11-12-23-14-16-8-10-19(26-16)17-5-3-4-6-18(17)22/h3-10,13,23H,11-12,14H2,1-2H3

Composition: C (70.97%), H (6.24%), F (5.35%), N (3.94%), O (13.50%)

Molar Mass: 355.409

Atom Count: 48

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 355.158371735
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XLNNPTWLDVJEJG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 99.22
Topological Polar Surface Area 43.63
Polarizability 39.4
Ring Count 3
Rotatable Bond Count 8

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H22FNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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