3-iodo-8-nitroquinoline

3-iodo-8-nitroquinoline

CAS: 497084-46-5

Formula: C9H5IN2O2

SMILES: [O-][N+](=O)C1=C2N=CC(I)=CC2=CC=C1

IUPAC: 3-iodo-8-nitroquinoline

InChI: InChI=1S/C9H5IN2O2/c10-7-4-6-2-1-3-8(12(13)14)9(6)11-5-7/h1-5H

Composition: C (36.03%), H (1.68%), I (42.29%), N (9.34%), O (10.66%)

Molar Mass: 300.055

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	299.93957
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	JTOBADNVHAZTAP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.66
Topological Polar Surface Area	56.03
Polarizability	23.98
Ring Count	2
Rotatable Bond Count	1

Suppliers

Key Organics Ltd

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	497084-46-5		$51.35-$180.26$51.35$63.37$86.31$113.62$180.26