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8-methyl-2-(4-propylphenyl)quinoline-4-carboxylic acid

8-methyl-2-(4-propylphenyl)quinoline-4-carboxylic acid

CAS: 445260-05-9

Formula: C20H19NO2

SMILES: CCCC1=CC=C(C=C1)C1=CC(C(O)=O)=C2C=CC=C(C)C2=N1

IUPAC: 8-methyl-2-(4-propylphenyl)quinoline-4-carboxylic acid

InChI: InChI=1S/C20H19NO2/c1-3-5-14-8-10-15(11-9-14)18-12-17(20(22)23)16-7-4-6-13(2)19(16)21-18/h4,6-12H,3,5H2,1-2H3,(H,22,23)

Composition: C (78.66%), H (6.27%), N (4.59%), O (10.48%)

Molar Mass: 305.377

Atom Count: 42

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 305.141578856
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey DSSSLXJJOHREEQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 91.28
Topological Polar Surface Area 50.19
Polarizability 37.54
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 445260-05-9 $101.60$101.60
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