8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylic acid

8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylic acid

CAS: 1823188-42-6

Formula: C9H4ClF3N2O2

SMILES: OC(=O)C1=CN=C2N1C=C(C=C2Cl)C(F)(F)F

IUPAC: 8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylic acid

InChI: InChI=1S/C9H4ClF3N2O2/c10-5-1-4(9(11,12)13)3-15-6(8(16)17)2-14-7(5)15/h1-3H,(H,16,17)

Composition: C (40.86%), H (1.52%), Cl (13.40%), F (21.54%), N (10.59%), O (12.09%)

Molar Mass: 264.59

Atom Count: 21

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	263.9913396
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XAXCHISMSFVBBE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.85
Topological Polar Surface Area	54.6
Polarizability	19.12
Ring Count	2
Rotatable Bond Count	2

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