5-nitro-6-(trifluoromethoxy)quinoline

5-nitro-6-(trifluoromethoxy)quinoline

CAS: 1133115-83-9

Formula: C10H5F3N2O3

SMILES: [O-][N+](=O)C1=C(OC(F)(F)F)C=CC2=NC=CC=C12

IUPAC: 5-nitro-6-(trifluoromethoxy)quinoline

InChI: InChI=1S/C10H5F3N2O3/c11-10(12,13)18-8-4-3-7-6(2-1-5-14-7)9(8)15(16)17/h1-5H

Composition: C (46.53%), H (1.95%), F (22.08%), N (10.85%), O (18.59%)

Molar Mass: 258.156

Atom Count: 23

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	258.025226518
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	UXFDSUZDFANKFP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.37
Topological Polar Surface Area	65.26
Polarizability	20.77
Ring Count	2
Rotatable Bond Count	3

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