2-(4-methylphenyl)-2-oxoethyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate

Base Information

• Chemical Name: 2-(4-methylphenyl)-2-oxoethyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
• CAS No.: 6625-49-6
• Molecular Formula: C27H23NO5
• Molecular Weight: 441.5
• DSSTox Substance ID: DTXSID60387728

Synonyms:STK270005;6625-49-6;DTXSID60387728;AKOS003285672;CCG-342998;2-(4-methylphenyl)-2-oxoethyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate;2-(4-Methylphenyl)-2-oxoethyl 3-(3,5-dioxo-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-en-4-yl)benzoate

Chemical Property of 2-(4-methylphenyl)-2-oxoethyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate

Chemical Property:

• Vapor Pressure: 3.68E-20mmHg at 25°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 441.15762283
• Heavy Atom Count: 33
• Complexity: 866

Purity/Quality:

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Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6

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