3-chloro-6-iodoimidazo[1,2-a]pyridine-2-carboxylic acid

3-chloro-6-iodoimidazo[1,2-a]pyridine-2-carboxylic acid

CAS: 900014-87-1

Formula: C8H4ClIN2O2

SMILES: OC(=O)C1=C(Cl)N2C=C(I)C=CC2=N1

IUPAC: 3-chloro-6-iodoimidazo[1,2-a]pyridine-2-carboxylic acid

InChI: InChI=1S/C8H4ClIN2O2/c9-7-6(8(13)14)11-5-2-1-4(10)3-12(5)7/h1-3H,(H,13,14)

Composition: C (29.80%), H (1.25%), Cl (10.99%), I (39.35%), N (8.69%), O (9.92%)

Molar Mass: 322.49

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	321.9006
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RQDBDTJYUKQYFO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.99
Topological Polar Surface Area	54.6
Polarizability	23.07
Ring Count	2
Rotatable Bond Count	1

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