Cas no 20611-11-4 (2-Dodecanol,1-mercapto-)
2-Dodecanol,1-mercapto- structure
Product Name:2-Dodecanol,1-mercapto-
2-Dodecanol,1-mercapto- Chemical and Physical Properties
Names and Identifiers
-
- 2-Dodecanol,1-mercapto-
- 1-sulfanyldodecan-2-ol
- 1-Mercaptododecan-2-ol
- DTXSID40942798
- 20611-11-4
- NS00051449
- EINECS 243-918-9
- SCHEMBL7791306
-
- Inchi： 1S/C12H26OS/c1-2-3-4-5-6-7-8-9-10-12(13)11-14/h12-14H,2-11H2,1H3
- InChI Key： GGMUJCCSBRQVTP-UHFFFAOYSA-N
- SMILES： SCC(CCCCCCCCCC)O
Computed Properties
- Exact Mass: 218.17058
- Monoisotopic Mass: 218.17
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 10
- Complexity: 107
- 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: 4.9
- Topological Polar Surface Area: 21.2?2
Experimental Properties
- Density: 0.915
- Boiling Point: 308.3°C at 760 mmHg
- Flash Point: 140.3°C
- Refractive Index: 1.473
- PSA: 20.23
2-Dodecanol,1-mercapto- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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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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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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