Cas no 29839-60-9 (3-Furanol,5-ethyltetrahydro-2,5-dimethyl-)
29839-60-9 structure
Product Name:3-Furanol,5-ethyltetrahydro-2,5-dimethyl-
3-Furanol,5-ethyltetrahydro-2,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Furanol,5-ethyltetrahydro-2,5-dimethyl-
- 5-ethyl-2,5-dimethyloxolan-3-ol
- 1,4-Anhydro-2,5-dideoxy-1-ethyl-1-methylpentitol
- DTXSID00952277
- 2,5-Dimethyl-5-ethyltetrahydro-3-furanol
- 29839-60-9
- 3-FURANOL, TETRAHYDRO-2,5-DIMETHYL-5-ETHYL-
-
- Inchi： 1S/C8H16O2/c1-4-8(3)5-7(9)6(2)10-8/h6-7,9H,4-5H2,1-3H3
- InChI Key： CXYOPONFFFZKNL-UHFFFAOYSA-N
- SMILES： O1C(C)C(CC1(C)CC)O
Computed Properties
- Exact Mass: 144.115029749g/mol
- Monoisotopic Mass: 144.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 124
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 29.5?2
3-Furanol,5-ethyltetrahydro-2,5-dimethyl- Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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