Cas no 94200-94-9 (1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl-)
![1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl- structure](https://ossimg.kuujia.com/scimg/94500/94200-94-9x500.png)
94200-94-9 structure
Product Name:1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl-
CAS No:94200-94-9
MF:C15H28O
MW:224.382225036621
CID:808165
PubChem ID:44153769
Update Time:2025-04-19
1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl-
- 3-methyl-8-(2-methylbutan-2-yl)-1-oxaspiro[4.5]decane
- 8-(1,1-dimethylpropyl)-3-methyl-1-oxaspiro[4.5]decane
- 94200-94-9
- DTXSID00916157
- NS00066450
- EINECS 303-574-3
- 8-(1,1-Dimethylpropyl)-3-methyl-1-oxaspiro(4.5)decane
-
- Inchi： 1S/C15H28O/c1-5-14(3,4)13-6-8-15(9-7-13)10-12(2)11-16-15/h12-13H,5-11H2,1-4H3
- InChI Key： WJEJFRYVWSCUOJ-UHFFFAOYSA-N
- SMILES： O1CC(C)CC21CCC(C(C)(C)CC)CC2
Computed Properties
- Exact Mass: 224.214
- Monoisotopic Mass: 224.214
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 236
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.6
- Topological Polar Surface Area: 9.2A^2
Experimental Properties
- Density: 0.9
- Boiling Point: 261.7°Cat760mmHg
- Flash Point: 99.6°C
- Refractive Index: 1.472
1-Oxaspiro[4.5]decane,8-(1,1-dimethylpropyl)-3-methyl- Related Literature
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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