Cas no 61757-74-2 (Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)-)
![Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)- structure](https://ossimg.kuujia.com/scimg/62000/61757-74-2x500.png)
61757-74-2 structure
Product Name:Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)-
CAS No:61757-74-2
MF:C12H13N3
MW:199.251722097397
CID:467281
PubChem ID:21414574
Update Time:2025-04-19
Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)-
- 3-(2-cyanoethyl)bicyclo[2.2.1]heptane-2,5-dicarbonitrile
- 61757-74-2
- DTXSID80613415
- SCHEMBL11760965
-
- Inchi： 1S/C12H13N3/c13-3-1-2-10-11-5-8(12(10)7-15)4-9(11)6-14/h8-12H,1-2,4-5H2
- InChI Key： LKPKWHQPZBDKHB-UHFFFAOYSA-N
- SMILES： N#CC1C(CCC#N)C2C(C#N)CC1C2
Computed Properties
- Exact Mass: 199.11109
- Monoisotopic Mass: 199.110947427g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 398
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.9
- Topological Polar Surface Area: 71.4?2
Experimental Properties
- PSA: 71.37
Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xinyi Liu,Huan Chen,Jing Lin,Yi Li,Liangqia Guo Chem. Commun., 2019,55, 2972-2975
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
61757-74-2 (Bicyclo[2.2.1]heptane-2,5-dicarbonitrile, 3-(2-cyanoethyl)-) Related Products
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