Cas no 408352-57-8 (4,6-Pyrimidinediamine,2-ethyl-)
408352-57-8 structure
Product Name:4,6-Pyrimidinediamine,2-ethyl-
CAS No:408352-57-8
MF:C6H10N4
MW:138.17040014267
CID:326207
PubChem ID:45080086
Update Time:2025-04-19
4,6-Pyrimidinediamine,2-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4,6-Pyrimidinediamine,2-ethyl-
- 2-ethylpyrimidine-4,6-diamine
- 4,6-Pyrimidinediamine, 2-ethyl- (9CI)
- 408352-57-8
- AKOS006360373
-
- Inchi： 1S/C6H10N4/c1-2-6-9-4(7)3-5(8)10-6/h3H,2H2,1H3,(H4,7,8,9,10)
- InChI Key： XLLIULZWETUHFA-UHFFFAOYSA-N
- SMILES： N1C(=CC(N)=NC=1CC)N
Computed Properties
- Exact Mass: 138.091
- Monoisotopic Mass: 138.091
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 95.9
- 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: 77.8A^2
- XLogP3: 0.3
4,6-Pyrimidinediamine,2-ethyl- 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
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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