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

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

CAS: 862710-17-6

Formula: C20H18ClNO2

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

IUPAC: 7-chloro-8-methyl-2-(4-propylphenyl)quinoline-4-carboxylic acid

InChI: InChI=1S/C20H18ClNO2/c1-3-4-13-5-7-14(8-6-13)18-11-16(20(23)24)15-9-10-17(21)12(2)19(15)22-18/h5-11H,3-4H2,1-2H3,(H,23,24)

Composition: C (70.69%), H (5.34%), Cl (10.43%), N (4.12%), O (9.42%)

Molar Mass: 339.82

Atom Count: 42

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 339.1026065
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QCBWPZTUSNRQBK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 96.09
Topological Polar Surface Area 50.19
Polarizability 39.34
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 862710-17-6 $101.60$101.60
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