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benzyl({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)amine

benzyl({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)amine

Formula: C21H19BrClNO

SMILES: ClC1=CC=C(COC2=CC=C(CNCC3=CC=CC=C3)C=C2Br)C=C1

IUPAC: benzyl({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)amine

InChI: InChI=1S/C21H19BrClNO/c22-20-12-18(14-24-13-16-4-2-1-3-5-16)8-11-21(20)25-15-17-6-9-19(23)10-7-17/h1-12,24H,13-15H2

Composition: C (60.52%), H (4.60%), Br (19.17%), Cl (8.51%), N (3.36%), O (3.84%)

Molar Mass: 416.74

Atom Count: 44

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 415.033855
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WWGGSSZRGDEPEZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 107.42
Topological Polar Surface Area 21.26
Polarizability 41.77
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H19BrClNO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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