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1-(4,5-dimethoxy-2-nitrobenzoyl)-3,5-dimethylpiperidine

1-(4,5-dimethoxy-2-nitrobenzoyl)-3,5-dimethylpiperidine

Formula: C16H22N2O5

SMILES: COC1=CC(C(=O)N2CC(C)CC(C)C2)=C(C=C1OC)[N+]([O-])=O

IUPAC: 1-(4,5-dimethoxy-2-nitrobenzoyl)-3,5-dimethylpiperidine

InChI: InChI=1/C16H22N2O5/c1-10-5-11(2)9-17(8-10)16(19)12-6-14(22-3)15(23-4)7-13(12)18(20)21/h6-7,10-11H,5,8-9H2,1-4H3

Composition: C (59.62%), H (6.88%), N (8.69%), O (24.82%)

Molar Mass: 322.361

Atom Count: 45

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 322.152871816
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey MHAZJPMWLRZBQZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.26
Topological Polar Surface Area 81.91
Polarizability 32.29
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H22N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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