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2-chloro-5-nitro-N-(pyridin-4-yl)benzamide

2-chloro-5-nitro-N-(pyridin-4-yl)benzamide

CAS: 313516-66-4

Formula: C12H8ClN3O3

SMILES: [O-][N+](=O)C1=CC(C(=O)NC2=CC=NC=C2)=C(Cl)C=C1

IUPAC: 2-chloro-5-nitro-N-(pyridin-4-yl)benzamide

InChI: InChI=1S/C12H8ClN3O3/c13-11-2-1-9(16(18)19)7-10(11)12(17)15-8-3-5-14-6-4-8/h1-7H,(H,14,15,17)

Composition: C (51.91%), H (2.90%), Cl (12.77%), N (15.13%), O (17.29%)

Molar Mass: 277.66

Atom Count: 27

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 277.0254188
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FRPJSHKMZHWJBE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.56
Topological Polar Surface Area 85.13
Polarizability 25.89
Ring Count 2
Rotatable Bond Count 3

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Wuhan ChemFaces Biochemical Co., Ltd
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Selleck Chemicals
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