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N-(4-acetylphenyl)-4-chloro-2-nitrobenzamide

N-(4-acetylphenyl)-4-chloro-2-nitrobenzamide

Formula: C15H11ClN2O4

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

IUPAC: N-(4-acetylphenyl)-4-chloro-2-nitrobenzamide

InChI: InChI=1S/C15H11ClN2O4/c1-9(19)10-2-5-12(6-3-10)17-15(20)13-7-4-11(16)8-14(13)18(21)22/h2-8H,1H3,(H,17,20)

Composition: C (56.53%), H (3.48%), Cl (11.12%), N (8.79%), O (20.08%)

Molar Mass: 318.71

Atom Count: 33

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 318.0407345
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey LJYBUDVNXOIHES-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 83.12
Topological Polar Surface Area 89.31
Polarizability 30.49
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H11ClN2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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