Cas no 40548-90-1 (3-Pyridinecarbonitrile,5-amino-4,6-dimethyl-)
40548-90-1 structure
Product Name:3-Pyridinecarbonitrile,5-amino-4,6-dimethyl-
3-Pyridinecarbonitrile,5-amino-4,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarbonitrile,5-amino-4,6-dimethyl-
- 5-AMINO-4,6-DIMETHYL-NICOTINONITRILE
- 5-amino-4,6-dimethylpyridine-3-carbonitrile
- 3-Amino-2,4-dimethyl-5-cyan-pyridin
- 5-amino-4,6-dimethylnicotinonitrile
- AC1L6K9W
- AC1Q4RIR
- AR-1G7156
- CTK4I3323
- F2113-0219
- NSC61970
- AKOS005207212
- DTXSID50289565
- NSC-61970
- 40548-90-1
- 5-Amino-4,6-dimethyl-nicotinonitrile,95+%
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- Inchi: 1S/C8H9N3/c1-5-7(3-9)4-11-6(2)8(5)10/h4H,10H2,1-2H3
- InChI Key: XQKOOEDXDWXHHV-UHFFFAOYSA-N
- SMILES: N1C=C(C#N)C(C)=C(C=1C)N
Computed Properties
- Exact Mass: 147.07977
- Monoisotopic Mass: 147.079647
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 181
- 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
- Topological Polar Surface Area: 62.7
- XLogP3: 0.7
Experimental Properties
- Density: 1.14
- Boiling Point: 358.5°C at 760 mmHg
- Flash Point: 170.6°C
- Refractive Index: 1.566
- PSA: 62.7
- LogP: 1.73348
3-Pyridinecarbonitrile,5-amino-4,6-dimethyl- Related Literature
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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