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[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amine; oxalic acid

[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amine; oxalic acid

CAS: 1158442-03-5

Formula: C18H20FNO6

SMILES: OC(=O)C(O)=O.COC1=CC=CC(CNCC2=CC=C(F)C=C2)=C1OC

IUPAC: [(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amine; oxalic acid

InChI: InChI=1S/C16H18FNO2.C2H2O4/c1-19-15-5-3-4-13(16(15)20-2)11-18-10-12-6-8-14(17)9-7-12;3-1(4)2(5)6/h3-9,18H,10-11H2,1-2H3;(H,3,4)(H,5,6)

Composition: C (59.17%), H (5.52%), F (5.20%), N (3.83%), O (26.27%)

Molar Mass: 365.357

Atom Count: 46

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 365.127465531
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey SYUHMQFKPHXDQG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.06
Topological Polar Surface Area 30.49
Polarizability 29.81
Ring Count 2
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1158442-03-5 $404.27$404.27
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