Cas no 89753-94-6 (Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester)
![Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester structure](https://ossimg.kuujia.com/scimg/90000/89753-94-6x500.png)
89753-94-6 structure
Product Name:Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester
CAS No:89753-94-6
MF:C11H15NO2
MW:193.242303133011
CID:590211
PubChem ID:71325961
Update Time:2025-04-19
Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester
- methyl 3-cyanobicyclo[2.2.2]octane-4-carboxylate
- 89753-94-6
- DTXSID00755220
- Methyl 2-cyanobicyclo[2.2.2]octane-1-carboxylate
-
- Inchi： 1S/C11H15NO2/c1-14-10(13)11-4-2-8(3-5-11)6-9(11)7-12/h8-9H,2-6H2,1H3
- InChI Key： PHMJGXYIGVGMNR-UHFFFAOYSA-N
- SMILES： O(C)C(C12CCC(CC1)CC2C#N)=O
Computed Properties
- Exact Mass: 193.110278721g/mol
- Monoisotopic Mass: 193.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 294
- 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: 1.6
- Topological Polar Surface Area: 50.1?2
Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
89753-94-6 (Bicyclo[2.2.2]octane-1-carboxylic acid, 2-cyano-, methyl ester) Related Products
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