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2-{[1,1'-biphenyl]-4-yl}-2-oxoethyl 2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)propanoate

2-{[1,1'-biphenyl]-4-yl}-2-oxoethyl 2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)propanoate

Formula: C25H15Cl4NO5

SMILES: CC(N1C(=O)C2=C(C1=O)C(Cl)=C(Cl)C(Cl)=C2Cl)C(=O)OCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: 2-{[1,1'-biphenyl]-4-yl}-2-oxoethyl 2-(4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate

InChI: InChI=1/C25H15Cl4NO5/c1-12(30-23(32)17-18(24(30)33)20(27)22(29)21(28)19(17)26)25(34)35-11-16(31)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12H,11H2,1H3

Composition: C (54.48%), H (2.74%), Cl (25.73%), N (2.54%), O (14.51%)

Molar Mass: 551.2

Atom Count: 50

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 548.9704334
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey DCWOJAUNRMSHMP-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 133.82
Topological Polar Surface Area 80.75
Polarizability 52.43
Ring Count 4
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H15Cl4NO5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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