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(4E)-4-({3,5-dichloro-2-[(2,6-dichlorophenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

(4E)-4-({3,5-dichloro-2-[(2,6-dichlorophenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

Formula: C23H14Cl4N2O3

SMILES: ClC1=CC(C=C2/C(=O)NN(C2=O)C2=CC=CC=C2)=C(OCC2=C(Cl)C=CC=C2Cl)C(Cl)=C1

IUPAC: (4E)-4-({3,5-dichloro-2-[(2,6-dichlorophenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

InChI: InChI=1S/C23H14Cl4N2O3/c24-14-9-13(10-16-22(30)28-29(23(16)31)15-5-2-1-3-6-15)21(20(27)11-14)32-12-17-18(25)7-4-8-19(17)26/h1-11H,12H2,(H,28,30)/b16-10+

Composition: C (54.36%), H (2.78%), Cl (27.90%), N (5.51%), O (9.44%)

Molar Mass: 508.18

Atom Count: 46

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 505.9758531
Formal Charge 0
FSP3 0.04
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey CCNLGRNFUMNMJE-MHWRWJLKSA-N
Lipinski's Rule of Five
Molar Refractivity 126.15
Topological Polar Surface Area 58.64
Polarizability 48.43
Ring Count 4
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H14Cl4N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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