ethyl 5-nitroimidazo[1,2-a]pyridine-3-carboxylate

ethyl 5-nitroimidazo[1,2-a]pyridine-3-carboxylate

CAS: 885271-33-0

Formula: C10H9N3O4

SMILES: CCOC(=O)C1=CN=C2C=CC=C(N12)[N+]([O-])=O

IUPAC: ethyl 5-nitroimidazo[1,2-a]pyridine-3-carboxylate

InChI: InChI=1S/C10H9N3O4/c1-2-17-10(14)7-6-11-8-4-3-5-9(12(7)8)13(15)16/h3-6H,2H2,1H3

Composition: C (51.07%), H (3.86%), N (17.87%), O (27.21%)

Molar Mass: 235.199

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	235.059305782
Formal Charge	0
FSP3	0.2
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	RQOMHKVOUZKYEF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.16
Topological Polar Surface Area	86.74
Polarizability	21.56
Ring Count	2
Rotatable Bond Count	4

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