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

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

CAS: 1121051-31-7

Formula: C9H4BrF3N2O2

SMILES: OC(=O)C1=CN2C=C(Br)C=C(C2=N1)C(F)(F)F

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

InChI: InChI=1S/C9H4BrF3N2O2/c10-4-1-5(9(11,12)13)7-14-6(8(16)17)3-15(7)2-4/h1-3H,(H,16,17)

Composition: C (34.98%), H (1.30%), Br (25.86%), F (18.44%), N (9.06%), O (10.35%)

Molar Mass: 309.042

Atom Count: 21

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	307.940825
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JDFYQROKYZZMOU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.42
Topological Polar Surface Area	54.6
Polarizability	20.28
Ring Count	2
Rotatable Bond Count	2

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