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2-(benzyloxy)-2-oxoethyl 2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetate

2-(benzyloxy)-2-oxoethyl 2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetate

CAS: 100499-89-6

Formula: C23H19Cl2NO4

SMILES: ClC1=CC=CC(Cl)=C1NC1=C(CC(=O)OCC(=O)OCC2=CC=CC=C2)C=CC=C1

IUPAC: 2-(benzyloxy)-2-oxoethyl 2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetate

InChI: InChI=1S/C23H19Cl2NO4/c24-18-10-6-11-19(25)23(18)26-20-12-5-4-9-17(20)13-21(27)30-15-22(28)29-14-16-7-2-1-3-8-16/h1-12,26H,13-15H2

Composition: C (62.18%), H (4.31%), Cl (15.96%), N (3.15%), O (14.40%)

Molar Mass: 444.31

Atom Count: 49

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 443.0691135
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RLKZSYGBKCIRFJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 115.7
Topological Polar Surface Area 64.63
Polarizability 45.15
Ring Count 3
Rotatable Bond Count 10

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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 100499-89-6 $80.58-$924.12$80.58$118.32$265.20$507.96$924.12
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