Cas no 33705-31-6 (2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone)
![2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone structure](https://ossimg.kuujia.com/scimg/34000/33705-31-6x500.png)
33705-31-6 structure
Product Name:2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
CAS No:33705-31-6
MF:C12H18O2
MW:194.270123958588
CID:1459665
PubChem ID:36585
Update Time:2025-04-20
2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone Chemical and Physical Properties
Names and Identifiers
-
- 2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
- 1-(1-adamantyl)-2-hydroxyethanone
- DTXSID60187386
- 1-adamantyl hydroxymethyl ketone
- AKOS020230336
- Ethanone, 1-(3-adamantyl)-2-hydroxy-
- 33705-31-6
- KETONE, 3-ADAMANTYL HYDROXYMETHYL
- Ethanone, 2-hydroxy-1-tricyclo[3.3.1.13,7]dec-1-yl-
- Ethanone, 2-hydroxy-1-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-, oxime
-
- Inchi： 1S/C12H18O2/c13-7-11(14)12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10,13H,1-7H2
- InChI Key： DJSXPNOHKQWGIH-UHFFFAOYSA-N
- SMILES： O=C(CO)C12CC3CC(CC(C3)C1)C2
Computed Properties
- Exact Mass: 194.13074
- Monoisotopic Mass: 194.131
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 228
- 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
- Topological Polar Surface Area: 37.3A^2
- XLogP3: 1.9
Experimental Properties
- Density: 1.192
- Boiling Point: 312°C at 760 mmHg
- Flash Point: 132.1°C
- Refractive Index: 1.562
- PSA: 37.3
2-hydroxy-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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