6-iodopyrazolo[1,5-a]pyridine-3-carboxylic acid

6-iodopyrazolo[1,5-a]pyridine-3-carboxylic acid

CAS: 1220039-46-2

Formula: C8H5IN2O2

SMILES: OC(=O)C1=C2C=CC(I)=CN2N=C1

IUPAC: 6-iodopyrazolo[1,5-a]pyridine-3-carboxylic acid

InChI: InChI=1S/C8H5IN2O2/c9-5-1-2-7-6(8(12)13)3-10-11(7)4-5/h1-4H,(H,12,13)

Composition: C (33.36%), H (1.75%), I (44.06%), N (9.73%), O (11.11%)

Molar Mass: 288.044

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	287.93957
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	USRMZLSAVLOZFQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.6
Topological Polar Surface Area	54.6
Polarizability	21.61
Ring Count	2
Rotatable Bond Count	1

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