Cas no 85443-74-9 (bis(isononanoato-O)(isooctanoato-O)cerium)
85443-74-9 structure
Product Name:bis(isononanoato-O)(isooctanoato-O)cerium
CAS No:85443-74-9
MF:C26H52CeO6
MW:600.803486824036
CID:733013
PubChem ID:119057943
Update Time:2024-03-01
bis(isononanoato-O)(isooctanoato-O)cerium Chemical and Physical Properties
Names and Identifiers
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- Cerium,bis(isononanoato-O)(isooctanoato-O)- (9CI)
- Bis(isononanoato-O)(isooctanoato-O)cerium
- CID 119057943
- Einecs 287-263-7
- bis(isononanoato-O)(isooctanoato-O)cerium
-
- Inchi： 1S/2C9H18O2.C8H16O2.Ce/c2*1-8(2)6-4-3-5-7-9(10)11;1-7(2)5-3-4-6-8(9)10;/h2*8H,3-7H2,1-2H3,(H,10,11);7H,3-6H2,1-2H3,(H,9,10);
- InChI Key： DKGPKUDDDKTYHW-UHFFFAOYSA-N
- SMILES： [Ce].OC(CCCCCC(C)C)=O.OC(CCCCCC(C)C)=O.OC(CCCCC(C)C)=O
Computed Properties
- Exact Mass: 600.28184g/mol
- Monoisotopic Mass: 600.28184g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 33
- Rotatable Bond Count: 17
- Complexity: 422
- Covalently-Bonded Unit Count: 4
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 112
bis(isononanoato-O)(isooctanoato-O)cerium Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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