Cas no 72764-26-2 (Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester)
![Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester structure](https://ossimg.kuujia.com/scimg/73000/72764-26-2x500.png)
72764-26-2 structure
Product Name:Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester
CAS No:72764-26-2
MF:C12H17NO2
MW:207.268883466721
CID:543461
PubChem ID:71404355
Update Time:2025-04-19
Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester
- ethyl 2-cyanobicyclo[2.2.2]octane-4-carboxylate
- DTXSID70825207
- Ethyl 3-cyanobicyclo[2.2.2]octane-1-carboxylate
- 72764-26-2
-
- Inchi： 1S/C12H17NO2/c1-2-15-11(14)12-5-3-9(4-6-12)10(7-12)8-13/h9-10H,2-7H2,1H3
- InChI Key： AUYFOAYJTAJPFL-UHFFFAOYSA-N
- SMILES： O(CC)C(C12CCC(CC1)C(C#N)C2)=O
Computed Properties
- Exact Mass: 207.12601
- Monoisotopic Mass: 207.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 307
- 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: 2
- Topological Polar Surface Area: 50.1?2
Experimental Properties
- PSA: 50.09
Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
72764-26-2 (Bicyclo[2.2.2]octane-1-carboxylic acid, 3-cyano-, ethyl ester) Related Products
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