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2-oxo-2-phenylethyl 8-chloro-2-(4-methylphenyl)quinoline-4-carboxylate

2-oxo-2-phenylethyl 8-chloro-2-(4-methylphenyl)quinoline-4-carboxylate

Formula: C25H18ClNO3

SMILES: CC1=CC=C(C=C1)C1=NC2=C(Cl)C=CC=C2C(=C1)C(=O)OCC(=O)C1=CC=CC=C1

IUPAC: 2-oxo-2-phenylethyl 8-chloro-2-(4-methylphenyl)quinoline-4-carboxylate

InChI: InChI=1S/C25H18ClNO3/c1-16-10-12-17(13-11-16)22-14-20(19-8-5-9-21(26)24(19)27-22)25(29)30-15-23(28)18-6-3-2-4-7-18/h2-14H,15H2,1H3

Composition: C (72.20%), H (4.36%), Cl (8.52%), N (3.37%), O (11.54%)

Molar Mass: 415.87

Atom Count: 48

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 415.0975211
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FIPXPUAHKGONKE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 116.52
Topological Polar Surface Area 56.26
Polarizability 47.5
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H18ClNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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