Cas no 89930-05-2 (Benzonitrile, 2-methyl-3-(2-pyridinyl)-)
89930-05-2 structure
Product Name:Benzonitrile, 2-methyl-3-(2-pyridinyl)-
CAS No:89930-05-2
MF:C13H10N2
MW:194.231902599335
CID:585068
PubChem ID:13245933
Update Time:2025-04-19
Benzonitrile, 2-methyl-3-(2-pyridinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2-methyl-3-(2-pyridinyl)-
- 2-methyl-3-pyridin-2-ylbenzonitrile
- 2-Methyl-3-(pyridin-2-yl)benzonitrile
- DTXSID60531648
- 89930-05-2
- SCHEMBL2363578
-
- Inchi： 1S/C13H10N2/c1-10-11(9-14)5-4-6-12(10)13-7-2-3-8-15-13/h2-8H,1H3
- InChI Key： UGHCGCHTKPDZEQ-UHFFFAOYSA-N
- SMILES： N1C=CC=CC=1C1C=CC=C(C#N)C=1C
Computed Properties
- Exact Mass: 194.084398327g/mol
- Monoisotopic Mass: 194.084398327g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 253
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 36.7?2
Benzonitrile, 2-methyl-3-(2-pyridinyl)- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
89930-05-2 (Benzonitrile, 2-methyl-3-(2-pyridinyl)-) Related Products
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