methyl 3-iodoimidazo[1,2-a]pyridine-8-carboxylate

methyl 3-iodoimidazo[1,2-a]pyridine-8-carboxylate

CAS: 885276-95-9

Formula: C9H7IN2O2

SMILES: COC(=O)C1=CC=CN2C(I)=CN=C12

IUPAC: methyl 3-iodoimidazo[1,2-a]pyridine-8-carboxylate

InChI: InChI=1S/C9H7IN2O2/c1-14-9(13)6-3-2-4-12-7(10)5-11-8(6)12/h2-5H,1H3

Composition: C (35.79%), H (2.34%), I (42.01%), N (9.27%), O (10.59%)

Molar Mass: 302.071

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	301.95522
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OXTNGJDEOUMONG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.62
Topological Polar Surface Area	43.6
Polarizability	23.1
Ring Count	2
Rotatable Bond Count	2

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