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[2-(4-fluorophenyl)ethyl][(4-nitrophenyl)methyl]amine hydrobromide

[2-(4-fluorophenyl)ethyl][(4-nitrophenyl)methyl]amine hydrobromide

CAS: 1609400-18-1

Formula: C15H16BrFN2O2

SMILES: Br.[O-][N+](=O)C1=CC=C(CNCCC2=CC=C(F)C=C2)C=C1

IUPAC: [2-(4-fluorophenyl)ethyl][(4-nitrophenyl)methyl]amine hydrobromide

InChI: InChI=1S/C15H15FN2O2.BrH/c16-14-5-1-12(2-6-14)9-10-17-11-13-3-7-15(8-4-13)18(19)20;/h1-8,17H,9-11H2;1H

Composition: C (50.72%), H (4.54%), Br (22.50%), F (5.35%), N (7.89%), O (9.01%)

Molar Mass: 355.207

Atom Count: 37

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 354.037919
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WUCXOTPSUGANKQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.21
Topological Polar Surface Area 55.17
Polarizability 28.41
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1609400-18-1 $28.75-$1,214.40$28.75$116.15$297.85$1,214.40
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