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3-methyl-1-[4-nitro-3-(piperidin-1-yl)phenyl]piperazine

3-methyl-1-[4-nitro-3-(piperidin-1-yl)phenyl]piperazine

Formula: C16H24N4O2

SMILES: CC1CN(CCN1)C1=CC=C(C(=C1)N1CCCCC1)[N+]([O-])=O

IUPAC: 3-methyl-1-[4-nitro-3-(piperidin-1-yl)phenyl]piperazine

InChI: InChI=1/C16H24N4O2/c1-13-12-19(10-7-17-13)14-5-6-15(20(21)22)16(11-14)18-8-3-2-4-9-18/h5-6,11,13,17H,2-4,7-10,12H2,1H3

Composition: C (63.13%), H (7.95%), N (18.41%), O (10.51%)

Molar Mass: 304.394

Atom Count: 46

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 304.189926029
Formal Charge 0
FSP3 0.62
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey AAKIMHLJHRBNET-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.55
Topological Polar Surface Area 61.65
Polarizability 32.95
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H24N4O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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