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decyl 8-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate

decyl 8-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate

Formula: C26H29Cl2NO2

SMILES: CCCCCCCCCCOC(=O)C1=CC(=NC2=C(Cl)C=CC=C12)C1=CC=C(Cl)C=C1

IUPAC: decyl 8-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate

InChI: InChI=1S/C26H29Cl2NO2/c1-2-3-4-5-6-7-8-9-17-31-26(30)22-18-24(19-13-15-20(27)16-14-19)29-25-21(22)11-10-12-23(25)28/h10-16,18H,2-9,17H2,1H3

Composition: C (68.12%), H (6.38%), Cl (15.47%), N (3.06%), O (6.98%)

Molar Mass: 458.42

Atom Count: 60

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 457.1575346
Formal Charge 0
FSP3 0.38
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey LTRNPJXTVGQXRR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 127.86
Topological Polar Surface Area 39.19
Polarizability 52.67
Ring Count 3
Rotatable Bond Count 12

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H29Cl2NO2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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