Cas no 75928-83-5 (2,4-Pyrimidinedicarbonitrile,5-methyl-)
75928-83-5 structure
Product Name:2,4-Pyrimidinedicarbonitrile,5-methyl-
CAS No:75928-83-5
MF:C7H4N4
MW:144.133460044861
CID:560727
PubChem ID:21785808
Update Time:2025-04-19
2,4-Pyrimidinedicarbonitrile,5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pyrimidinedicarbonitrile,5-methyl-
- 2,4-Pyrimidinedicarbonitrile, 5-methyl- (9CI)
- 5-methylpyrimidine-2,4-dicarbonitrile
- DTXSID40618022
- 75928-83-5
-
- Inchi： 1S/C7H4N4/c1-5-4-10-7(3-9)11-6(5)2-8/h4H,1H3
- InChI Key： RRKTZLVWOGSSBF-UHFFFAOYSA-N
- SMILES： N1C(C#N)=NC=C(C)C=1C#N
Computed Properties
- Exact Mass: 144.043596145g/mol
- Monoisotopic Mass: 144.043596145g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 229
- 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: 0.7
- Topological Polar Surface Area: 73.4?2
2,4-Pyrimidinedicarbonitrile,5-methyl- Related Literature
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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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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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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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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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