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cyclohexyl 2-phenylquinoline-4-carboxylate

cyclohexyl 2-phenylquinoline-4-carboxylate

Formula: C22H21NO2

SMILES: O=C(OC1CCCCC1)C1=CC(=NC2=CC=CC=C12)C1=CC=CC=C1

IUPAC: cyclohexyl 2-phenylquinoline-4-carboxylate

InChI: InChI=1S/C22H21NO2/c24-22(25-17-11-5-2-6-12-17)19-15-21(16-9-3-1-4-10-16)23-20-14-8-7-13-18(19)20/h1,3-4,7-10,13-15,17H,2,5-6,11-12H2

Composition: C (79.73%), H (6.39%), N (4.23%), O (9.65%)

Molar Mass: 331.415

Atom Count: 46

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 331.15722892
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BJQGTYBXVXJFTR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 97.78
Topological Polar Surface Area 39.19
Polarizability 40.93
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H21NO2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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