Cas no 62813-76-7 (Undecane, 5-methoxy-5-methyl-)
Undecane, 5-methoxy-5-methyl- structure
Product Name:Undecane, 5-methoxy-5-methyl-
CAS No:62813-76-7
MF:C13H28O
MW:200.360824584961
CID:430572
PubChem ID:71382508
Update Time:2025-04-19
Undecane, 5-methoxy-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Undecane, 5-methoxy-5-methyl-
- 5-methoxy-5-methylundecane
- DTXSID20804885
- 62813-76-7
-
- Inchi： 1S/C13H28O/c1-5-7-9-10-12-13(3,14-4)11-8-6-2/h5-12H2,1-4H3
- InChI Key： IIPWCGGQHGZQCN-UHFFFAOYSA-N
- SMILES： O(C)C(C)(CCCC)CCCCCC
Computed Properties
- Exact Mass: 200.21414
- Monoisotopic Mass: 200.214015512g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 9
- Complexity: 122
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Undecane, 5-methoxy-5-methyl- Related Literature
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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