7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid

7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid

CAS: 863437-96-1

Formula: C17H10Cl3NO2

SMILES: CC1=C(Cl)C=CC2=C(C=C(N=C12)C1=C(Cl)C=CC(Cl)=C1)C(O)=O

IUPAC: 7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid

InChI: InChI=1S/C17H10Cl3NO2/c1-8-13(19)5-3-10-11(17(22)23)7-15(21-16(8)10)12-6-9(18)2-4-14(12)20/h2-7H,1H3,(H,22,23)

Composition: C (55.69%), H (2.75%), Cl (29.01%), N (3.82%), O (8.73%)

Molar Mass: 366.62

Atom Count: 33

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	364.9777117
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	IMAWAZYPLZKRDE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	91.46
Topological Polar Surface Area	50.19
Polarizability	37.59
Ring Count	3
Rotatable Bond Count	2

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