Cas no 1247386-17-9 (2-Ethyl-6-isopropylpyrimidin-4-amine)
1247386-17-9 structure
Product Name:2-Ethyl-6-isopropylpyrimidin-4-amine
CAS No:1247386-17-9
MF:C9H15N3
MW:165.235501527786
CID:2141039
Update Time:2023-08-03
2-Ethyl-6-isopropylpyrimidin-4-amine Chemical and Physical Properties
Names and Identifiers
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- 2-ethyl-6-isopropylpyrimidin-4-amine
- 2-Ethyl-6-isopropylpyrimidin-4-amine
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- Inchi： 1S/C9H15N3/c1-4-9-11-7(6(2)3)5-8(10)12-9/h5-6H,4H2,1-3H3,(H2,10,11,12)
- InChI Key： PZBTZNCXADXLHE-UHFFFAOYSA-N
- SMILES： N1C(CC)=NC(=CC=1C(C)C)N
Computed Properties
- Exact Mass: 165.127
- Monoisotopic Mass: 165.127
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 136
- 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: 51.8
2-Ethyl-6-isopropylpyrimidin-4-amine Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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