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5-nitro-2-(2-{[4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)pyridine

5-nitro-2-(2-{[4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)pyridine

Formula: C16H17N5O2

SMILES: [O-][N+](=O)C1=CC=C(N=NCC2=CC=C(C=C2)N2CCCC2)N=C1

IUPAC: 5-nitro-2-(2-{[4-(pyrrolidin-1-yl)phenyl]methyl}diazen-1-yl)pyridine

InChI: InChI=1S/C16H17N5O2/c22-21(23)15-7-8-16(17-12-15)19-18-11-13-3-5-14(6-4-13)20-9-1-2-10-20/h3-8,12H,1-2,9-11H2

Composition: C (61.72%), H (5.50%), N (22.49%), O (10.28%)

Molar Mass: 311.345

Atom Count: 40

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 311.138224807
Formal Charge 0
FSP3 0.31
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey AXZRBPCPFOVHNK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.64
Topological Polar Surface Area 83.99
Polarizability 32.19
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H17N5O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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