Cas no 62902-16-3 (Decanedioic acid, bis(2-methyl-4-oxo-4H-pyran-3-yl) ester)
62902-16-3 structure
Product Name:Decanedioic acid, bis(2-methyl-4-oxo-4H-pyran-3-yl) ester
CAS No:62902-16-3
MF:C22H26O8
MW:418.437047481537
CID:390471
PubChem ID:71373657
Update Time:2025-04-19
Decanedioic acid, bis(2-methyl-4-oxo-4H-pyran-3-yl) ester Chemical and Physical Properties
Names and Identifiers
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- Decanedioic acid, bis(2-methyl-4-oxo-4H-pyran-3-yl) ester
- bis(2-methyl-4-oxopyran-3-yl) decanedioate
- 62902-16-3
- DTXSID40796475
- Bis(2-methyl-4-oxo-4H-pyran-3-yl) decanedioate
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- Inchi： 1S/C22H26O8/c1-15-21(17(23)11-13-27-15)29-19(25)9-7-5-3-4-6-8-10-20(26)30-22-16(2)28-14-12-18(22)24/h11-14H,3-10H2,1-2H3
- InChI Key： SLVDYUZEZNLAGN-UHFFFAOYSA-N
- SMILES： O(C1C(C=COC=1C)=O)C(CCCCCCCCC(=O)OC1C(C=COC=1C)=O)=O
Computed Properties
- Exact Mass: 418.16276778g/mol
- Monoisotopic Mass: 418.16276778g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 30
- Rotatable Bond Count: 13
- Complexity: 745
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 105?2
Decanedioic acid, bis(2-methyl-4-oxo-4H-pyran-3-yl) ester Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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