Cas no 89930-02-9 (Benzonitrile, 2-methyl-3-(3-pyridinyl)-)
89930-02-9 structure
Product Name:Benzonitrile, 2-methyl-3-(3-pyridinyl)-
CAS No:89930-02-9
MF:C13H10N2
MW:194.231902599335
CID:585071
PubChem ID:13245932
Update Time:2025-04-19
Benzonitrile, 2-methyl-3-(3-pyridinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2-methyl-3-(3-pyridinyl)-
- 2-methyl-3-pyridin-3-ylbenzonitrile
- DTXSID00531647
- 89930-02-9
- SCHEMBL2146568
- AVTWYROZGKAXGE-UHFFFAOYSA-N
- 2-Methyl-3-(pyridin-3-yl)benzonitrile
- 3 -(3-cyano-2-methylphenyl)pyridine
-
- Inchi： 1S/C13H10N2/c1-10-11(8-14)4-2-6-13(10)12-5-3-7-15-9-12/h2-7,9H,1H3
- InChI Key： AVTWYROZGKAXGE-UHFFFAOYSA-N
- SMILES： N1C=CC=C(C=1)C1C=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-(3-pyridinyl)- Related Literature
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
89930-02-9 (Benzonitrile, 2-methyl-3-(3-pyridinyl)-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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