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1-benzoyl-4-(4-nitrophenyl)piperazine

1-benzoyl-4-(4-nitrophenyl)piperazine

Formula: C17H17N3O3

SMILES: [O-][N+](=O)C1=CC=C(C=C1)N1CCN(CC1)C(=O)C1=CC=CC=C1

IUPAC: 1-benzoyl-4-(4-nitrophenyl)piperazine

InChI: InChI=1S/C17H17N3O3/c21-17(14-4-2-1-3-5-14)19-12-10-18(11-13-19)15-6-8-16(9-7-15)20(22)23/h1-9H,10-13H2

Composition: C (65.58%), H (5.50%), N (13.50%), O (15.42%)

Molar Mass: 311.341

Atom Count: 40

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 311.126991419
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey KFWDPENVQUYXSR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.8
Topological Polar Surface Area 66.69
Polarizability 32.4
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H17N3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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