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N'-[(Z)-(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-2H,3H-naphtho[2,3-b][1,4]dioxine-2-carbohydrazide

N'-[(Z)-(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-2H,3H-naphtho[2,3-b][1,4]dioxine-2-carbohydrazide

Formula: C20H14ClN3O6

SMILES: OC1=C(C=C(Cl)C=C1C=N/NC(=O)C1COC2=CC3=CC=CC=C3C=C2O1)[N+]([O-])=O

IUPAC: N'-[(Z)-(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-2H,3H-naphtho[2,3-b][1,4]dioxine-2-carbohydrazide

InChI: InChI=1/C20H14ClN3O6/c21-14-5-13(19(25)15(8-14)24(27)28)9-22-23-20(26)18-10-29-16-6-11-3-1-2-4-12(11)7-17(16)30-18/h1-9,18,25H,10H2,(H,23,26)/b22-9-

Composition: C (56.15%), H (3.30%), Cl (8.29%), N (9.82%), O (22.44%)

Molar Mass: 427.8

Atom Count: 44

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 427.0571129
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey JGJCLAKLUTZSIJ-AFPJDJCSNA-N
Lipinski's Rule of Five 1
Molar Refractivity 107.32
Topological Polar Surface Area 123.29
Polarizability 41.74
Ring Count 4
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H14ClN3O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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