Cas no 68651-47-8 (Isoxeniaphyllenol)
Isoxeniaphyllenol structure
Product Name:Isoxeniaphyllenol
CAS No:68651-47-8
MF:C20H32O
MW:288.467486381531
CID:2011907
PubChem ID:53439079
Update Time:2025-04-21
Isoxeniaphyllenol Chemical and Physical Properties
Names and Identifiers
-
- Isoxeniaphyllenol
- 5-(4,11-dimethyl-8-methylidene-11-bicyclo[7.2.0]undec-4-enyl)-2-methylpent-3-en-2-ol
- 5-(6,10-Dimethyl-2-methylenebicyclo[7.2.0]undec-5-en-10-yl)-2-methyl-3-penten-2-ol
- DTXSID30701715
- 5-(6,10-Dimethyl-2-methylidenebicyclo[7.2.0]undec-5-en-10-yl)-2-methylpent-3-en-2-ol
- 68651-47-8
-
- Inchi： 1S/C20H32O/c1-15-8-6-9-16(2)17-14-20(5,18(17)11-10-15)13-7-12-19(3,4)21/h7-8,12,17-18,21H,2,6,9-11,13-14H2,1,3-5H3
- InChI Key： BLKYNXQZVZSPOH-UHFFFAOYSA-N
- SMILES： OC(C)(C)C=CCC1(C)CC2C(=C)CCC=C(C)CCC12
Computed Properties
- Exact Mass: 288.245315640g/mol
- Monoisotopic Mass: 288.245315640g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 455
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 2
- XLogP3: 4.5
- Topological Polar Surface Area: 20.2?2
Isoxeniaphyllenol Related Literature
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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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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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