Cas no 136829-88-4 (Neononaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester)
136829-88-4 structure
Product Name:Neononaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester
CAS No:136829-88-4
MF:C17H34O3
MW:286.45006608963
CID:1241473
PubChem ID:71341479
Update Time:2025-04-20
Neononaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester Chemical and Physical Properties
Names and Identifiers
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- Neononaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester
- 2,4,4-trimethylpentan-2-yl 6,6-dimethylheptaneperoxoate
- 136829-88-4
- SCHEMBL25324798
- DTXSID80768398
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- Inchi: 1S/C17H34O3/c1-15(2,3)12-10-9-11-14(18)19-20-17(7,8)13-16(4,5)6/h9-13H2,1-8H3
- InChI Key: QWBQEYPKFKTAQW-UHFFFAOYSA-N
- SMILES: O(C(C)(C)CC(C)(C)C)OC(CCCCC(C)(C)C)=O
Computed Properties
- Exact Mass: 286.25079494g/mol
- Monoisotopic Mass: 286.25079494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 10
- Complexity: 292
- 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: 6
- Topological Polar Surface Area: 35.5?2
Neononaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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