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4',4''(5'')-Diacetyldibenzo-18-Crown-6
[CAS# 68817-65-2]

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Identification
Name 4',4''(5'')-Diacetyldibenzo-18-Crown-6
Synonyms St023564; 1-(13-Acetyl-6,7,9,10,17,18,20,21-Octahydro-5,8,11,16,19,22-Hexaoxa-Dibenzo[A,J]Cyclooctadecen-2-Y L)-Ethanone; Zinc04256146
Molecular Structure CAS#: 68817-65-2, 4',4''(5'')-Diacetyldibenzo-18-Crown-6
Molecular Formula C24H28O8
Molecular Weight 444.48
CAS Registry Number 68817-65-2
SMILES C1=C(C(C)=O)C=CC2=C1OCCOCCOC3=C(OCCOCCO2)C=C(C(C)=O)C=C3
InChI 1S/C24H28O8/c1-17(25)19-3-5-21-23(15-19)31-13-9-27-8-12-30-22-6-4-20(18(2)26)16-24(22)32-14-10-28-7-11-29-21/h3-6,15-16H,7-14H2,1-2H3
InChIKey HPAWAIFDXKBZGU-UHFFFAOYSA-N
Properties
Density 1.145g/cm3 (Cal.)
Boiling point 641.74°C at 760 mmHg (Cal.)
Flash point 275.791°C (Cal.)
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