Cas no 100517-02-0 (3-Pyridinol,2,6-diamino-(6CI))
3-Pyridinol,2,6-diamino-(6CI) structure
Product Name:3-Pyridinol,2,6-diamino-(6CI)
CAS No:100517-02-0
MF:C5H7N3O
MW:125.128580331802
CID:892936
Update Time:2025-04-19
3-Pyridinol,2,6-diamino-(6CI) Chemical and Physical Properties
Names and Identifiers
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- 3-Pyridinol,2,6-diamino-(6CI)
- 3-Pyridinol, 2,6-diaMino-
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- Inchi： 1S/C5H7N3O/c6-4-2-1-3(9)5(7)8-4/h1-2,9H,(H4,6,7,8)
- InChI Key： VZRMDLPJHQLXGP-UHFFFAOYSA-N
- SMILES： C1(N)=NC(N)=CC=C1O
Computed Properties
- Exact Mass: 125.058912g/mol
- Monoisotopic Mass: 125.058912g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 98.2
- 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
- Molecular Weight: 125.13g/mol
- XLogP3: -0.2
- Topological Polar Surface Area: 85.2?2
3-Pyridinol,2,6-diamino-(6CI) Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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