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N'-[(E)-(4-hydroxy-3-methoxy-2-nitrophenyl)methylidene]tert-butoxycarbohydrazide

N'-[(E)-(4-hydroxy-3-methoxy-2-nitrophenyl)methylidene]tert-butoxycarbohydrazide

Formula: C13H17N3O6

SMILES: COC1=C(O)C=CC(C=NNC(=O)OC(C)(C)C)=C1[N+]([O-])=O

IUPAC: N'-[(E)-(4-hydroxy-3-methoxy-2-nitrophenyl)methylidene](tert-butoxy)carbohydrazide

InChI: InChI=1S/C13H17N3O6/c1-13(2,3)22-12(18)15-14-7-8-5-6-9(17)11(21-4)10(8)16(19)20/h5-7,17H,1-4H3,(H,15,18)/b14-7+

Composition: C (50.16%), H (5.50%), N (13.50%), O (30.84%)

Molar Mass: 311.294

Atom Count: 39

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 311.111735279
Formal Charge 0
FSP3 0.38
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey ZDRJBHYWIBBEMS-VGOFMYFVSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.76
Topological Polar Surface Area 123.29
Polarizability 29.16
Ring Count 1
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H17N3O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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