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2,6-dimethyl 4-iodopyridine-2,6-dicarboxylate

2,6-dimethyl 4-iodopyridine-2,6-dicarboxylate

Formula: C9H8INO4

SMILES: COC(=O)C1=CC(I)=CC(=N1)C(=O)OC

IUPAC: 2,6-dimethyl 4-iodopyridine-2,6-dicarboxylate

InChI: InChI=1S/C9H8INO4/c1-14-8(12)6-3-5(10)4-7(11-6)9(13)15-2/h3-4H,1-2H3

Composition: C (33.67%), H (2.51%), I (39.53%), N (4.36%), O (19.93%)

Molar Mass: 321.07

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 320.9498
Formal Charge 0
FSP3 0.22
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey OIFGTELVXIXXQU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.57
Topological Polar Surface Area 65.49
Polarizability 23.76
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
98% <7 Days C9H8INO4 $39.27-$1,699.83$39.27$73.87$148.67$446.93$771.38$1,699.83
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98% <10 Days C9H8INO4 Quote Only
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