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

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

CAS: 438232-72-5

Formula: C20H19NO3

SMILES: CCCOC1=CC=C(C=C1)C1=CC(C(O)=O)=C2C=CC=C(C)C2=N1

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

InChI: InChI=1S/C20H19NO3/c1-3-11-24-15-9-7-14(8-10-15)18-12-17(20(22)23)16-6-4-5-13(2)19(16)21-18/h4-10,12H,3,11H2,1-2H3,(H,22,23)

Composition: C (74.75%), H (5.96%), N (4.36%), O (14.93%)

Molar Mass: 321.376

Atom Count: 43

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 321.136493476
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey AECQLQVREKZPKO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 92.78
Topological Polar Surface Area 59.42
Polarizability 38.25
Ring Count 3
Rotatable Bond Count 5

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95% <2 Days 438232-72-5 $101.60$101.60
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