2-(3-hydroxyphenyl)-6-methylquinoline-4-carboxylic acid

2-(3-hydroxyphenyl)-6-methylquinoline-4-carboxylic acid

CAS: 669740-21-0

Formula: C17H13NO3

SMILES: CC1=CC=C2N=C(C=C(C(O)=O)C2=C1)C1=CC(O)=CC=C1

IUPAC: 2-(3-hydroxyphenyl)-6-methylquinoline-4-carboxylic acid

InChI: InChI=1S/C17H13NO3/c1-10-5-6-15-13(7-10)14(17(20)21)9-16(18-15)11-3-2-4-12(19)8-11/h2-9,19H,1H3,(H,20,21)

Composition: C (73.11%), H (4.69%), N (5.02%), O (17.19%)

Molar Mass: 279.295

Atom Count: 34

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	279.089543283
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	GSROLMPDPXBJPI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.02
Topological Polar Surface Area	70.42
Polarizability	32.63
Ring Count	3
Rotatable Bond Count	2

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