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(E)-5-Bis[[(E)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl]oxy]bismuthanyloxy-2,2,6,6-tetramethylhept-4-en-3-one

Catalog Number ACM142617536-1
CAS 142617-53-6
Structure (E)-5-Bis[[(E)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl]oxy]bismuthanyloxy-2,2,6,6-tetramethylhept-4-en-3-one
Synonyms (4E)-5-[(Bis{[(3E)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl]oxy}bismuthanyl)oxy]-2,2,6,6-tetramethylhept-4-en-3-one
Molecular Weight 758.8
Molecular Formula C33H57BiO6
Canonical SMILES CC(C)(C)C(=CC(=O)C(C)(C)C)O[Bi](OC(=CC(=O)C(C)(C)C)C(C)(C)C)OC(=CC(=O)C(C)(C)C)C(C)(C)C
InChI InChI=1S/3C11H20O2.Bi/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7,12H,1-6H3;/q;+3/p-3/b3*8-7+;
InChI Key ZNHBPQSSVCRFST-QFVJJVGWSA-K
Exact Mass 758.39591
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
Isomeric SMILES CC(/C(=C\C(=O)C(C)(C)C)/O[Bi](O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)(C)C
Monoisotopic Mass 758.39591
Rotatable Bond Count 15
Topological Polar Surface Area 78.9 Ų

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