2-(2,5-dimethylphenyl)-6,8-dimethylquinoline-4-carboxylic acid

2-(2,5-dimethylphenyl)-6,8-dimethylquinoline-4-carboxylic acid

CAS: 438228-75-2

Formula: C20H19NO2

SMILES: CC1=CC(=C(C)C=C1)C1=CC(C(O)=O)=C2C=C(C)C=C(C)C2=N1

IUPAC: 2-(2,5-dimethylphenyl)-6,8-dimethylquinoline-4-carboxylic acid

InChI: InChI=1S/C20H19NO2/c1-11-5-6-13(3)15(8-11)18-10-17(20(22)23)16-9-12(2)7-14(4)19(16)21-18/h5-10H,1-4H3,(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	BMNWQXZWCBFBSV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	92.16
Topological Polar Surface Area	50.19
Polarizability	37.38
Ring Count	3
Rotatable Bond Count	2

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