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2-(4-methylphenoxy)-N'-[(Z)-(6-oxo-3-{2-[3-(trifluoromethyl)phenyl]hydrazin-1-ylidene}cyclohexa-1,4-dien-1-yl)methylidene]acetohydrazide

2-(4-methylphenoxy)-N'-[(Z)-(6-oxo-3-{2-[3-(trifluoromethyl)phenyl]hydrazin-1-ylidene}cyclohexa-1,4-dien-1-yl)methylidene]acetohydrazide

Formula: C23H19F3N4O3

SMILES: CC1=CC=C(OCC(=O)NN=C/C2=CC(C=CC2=O)=NNC2=CC=CC(=C2)C(F)(F)F)C=C1

IUPAC: 2-(4-methylphenoxy)-N'-[(Z)-(6-oxo-3-{2-[3-(trifluoromethyl)phenyl]hydrazin-1-ylidene}cyclohexa-1,4-dien-1-yl)methylidene]acetohydrazide

InChI: InChI=1S/C23H19F3N4O3/c1-15-5-8-20(9-6-15)33-14-22(32)30-27-13-16-11-19(7-10-21(16)31)29-28-18-4-2-3-17(12-18)23(24,25)26/h2-13,28H,14H2,1H3,(H,30,32)/b27-13-,29-19?

Composition: C (60.53%), H (4.20%), F (12.49%), N (12.28%), O (10.52%)

Molar Mass: 456.425

Atom Count: 52

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 456.140924977
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey JJEPZVKEEFHXFE-VUKRNZGNSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.82
Topological Polar Surface Area 92.15
Polarizability 42.68
Ring Count 3
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H19F3N4O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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