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3-[9-(pyridin-3-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]pyridine

3-[9-(pyridin-3-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]pyridine

Formula: C17H18N2O4

SMILES: C1OC(OCC11COC(OC1)C1=CC=CN=C1)C1=CC=CN=C1

IUPAC: 3-[9-(pyridin-3-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]pyridine

InChI: InChI=1S/C17H18N2O4/c1-3-13(7-18-5-1)15-20-9-17(10-21-15)11-22-16(23-12-17)14-4-2-6-19-8-14/h1-8,15-16H,9-12H2

Composition: C (64.96%), H (5.77%), N (8.91%), O (20.36%)

Molar Mass: 314.341

Atom Count: 41

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 314.126657068
Formal Charge 0
FSP3 0.41
Hetero Ring Count 4
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey MMWCTODJHSJKPN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.18
Topological Polar Surface Area 62.7
Polarizability 32.34
Ring Count 4
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H18N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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