Cas no 94401-70-4 (Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis-)
94401-70-4 structure
Product Name:Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis-
CAS No:94401-70-4
MF:C15H28O4
MW:272.380425453186
CID:735326
PubChem ID:57072167
Update Time:2025-04-19
Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis-
- 2-[[2-ethyl-2-(oxiran-2-ylmethoxymethyl)hexoxy]methyl]oxirane
- SCHEMBL7518578
- 94401-70-4
- DTXSID70720223
- 2-{[(2-Ethyl-2-{[(oxiran-2-yl)methoxy]methyl}hexyl)oxy]methyl}oxirane
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- Inchi: 1S/C15H28O4/c1-3-5-6-15(4-2,11-16-7-13-9-18-13)12-17-8-14-10-19-14/h13-14H,3-12H2,1-2H3
- InChI Key: XKLGZQIUTOYSBB-UHFFFAOYSA-N
- SMILES: O(CC1CO1)CC(COCC1CO1)(CC)CCCC
Computed Properties
- Exact Mass: 272.19875937g/mol
- Monoisotopic Mass: 272.19875937g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 12
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 43.5?2
Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
94401-70-4 (Oxirane, 2,2'-[(2-butyl-2-ethyl-1,3-propanediyl)bis(oxymethylene)]bis-) Related Products
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