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2-[2-(4-nitrophenoxy)acetamido]benzoic acid

2-[2-(4-nitrophenoxy)acetamido]benzoic acid

Formula: C15H12N2O6

SMILES: OC(=O)C1=CC=CC=C1NC(=O)COC1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 2-[2-(4-nitrophenoxy)acetamido]benzoic acid

InChI: InChI=1S/C15H12N2O6/c18-14(16-13-4-2-1-3-12(13)15(19)20)9-23-11-7-5-10(6-8-11)17(21)22/h1-8H,9H2,(H,16,18)(H,19,20)

Composition: C (56.97%), H (3.82%), N (8.86%), O (30.35%)

Molar Mass: 316.269

Atom Count: 35

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 316.069536114
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey NEYFREBYKGTFIF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.46
Topological Polar Surface Area 118.77
Polarizability 29.79
Ring Count 2
Rotatable Bond Count 6

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H12N2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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