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

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

Formula: C27H32ClNO2

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

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

InChI: InChI=1S/C27H32ClNO2/c1-3-4-5-6-7-8-9-10-18-31-27(30)23-19-25(21-16-14-20(2)15-17-21)29-26-22(23)12-11-13-24(26)28/h11-17,19H,3-10,18H2,1-2H3

Composition: C (74.04%), H (7.36%), Cl (8.09%), N (3.20%), O (7.31%)

Molar Mass: 438.01

Atom Count: 63

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 437.212157
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WLADNDBIQLEBIM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 128.09
Topological Polar Surface Area 39.19
Polarizability 52.63
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 C27H32ClNO2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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