Cas no 62813-73-4 (Hexane, 3-ethyl-3-(hexyloxy)-)
Hexane, 3-ethyl-3-(hexyloxy)- structure
Product Name:Hexane, 3-ethyl-3-(hexyloxy)-
CAS No:62813-73-4
MF:C14H30O
MW:214.387404918671
CID:430575
PubChem ID:71382511
Update Time:2025-04-19
Hexane, 3-ethyl-3-(hexyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Hexane, 3-ethyl-3-(hexyloxy)-
- 3-ethyl-3-hexoxyhexane
- 3-ETHYL-3-(HEXYLOXY)HEXANE
- 62813-73-4
- DTXSID00804888
-
- Inchi： 1S/C14H30O/c1-5-9-10-11-13-15-14(7-3,8-4)12-6-2/h5-13H2,1-4H3
- InChI Key： LARCCYLPFIELNG-UHFFFAOYSA-N
- SMILES： O(CCCCCC)C(CC)(CC)CCC
Computed Properties
- Exact Mass: 214.2298
- Monoisotopic Mass: 214.229665576g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 10
- Complexity: 127
- 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: 5.3
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Hexane, 3-ethyl-3-(hexyloxy)- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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