Cas no 118208-00-7 (Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)-)
![Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)- structure](https://ossimg.kuujia.com/scimg/118500/118208-00-7x500.png)
118208-00-7 structure
Product Name:Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)-
CAS No:118208-00-7
MF:C12H19ClO
MW:214.731662988663
CID:132906
PubChem ID:45081228
Update Time:2025-04-19
Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)-
- 2-propan-2-ylbicyclo[2.2.2]octane-3-carbonyl chloride
- Bicyclo[2.2.2]octane-2-carbonyl chloride, 3-(1-methylethyl)- (9CI)
- 118208-00-7
- 3-(Propan-2-yl)bicyclo[2.2.2]octane-2-carbonyl chloride
- DTXSID70664451
-
- Inchi： 1S/C12H19ClO/c1-7(2)10-8-3-5-9(6-4-8)11(10)12(13)14/h7-11H,3-6H2,1-2H3
- InChI Key： YEUINWDONJBYJB-UHFFFAOYSA-N
- SMILES： ClC(C1C2CCC(CC2)C1C(C)C)=O
Computed Properties
- Exact Mass: 214.11257
- Monoisotopic Mass: 214.1124429g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 229
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.6
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Bicyclo[2.2.2]octane-2-carbonylchloride, 3-(1-methylethyl)- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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