Cas no 95508-57-9 (Pyridinetriol, methyl-)
Pyridinetriol, methyl- structure
Product Name:Pyridinetriol, methyl-
CAS No:95508-57-9
MF:C6H7NO3
MW:141.124681711197
CID:734989
PubChem ID:71330925
Update Time:2025-04-19
Pyridinetriol, methyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyridinetriol, methyl-
- 3,4-dihydroxy-5-methyl-1H-pyridin-2-one
- 3,4-Dihydroxy-5-methylpyridin-2(1H)-one
- 95508-57-9
- DTXSID60759567
-
- Inchi： 1S/C6H7NO3/c1-3-2-7-6(10)5(9)4(3)8/h2,9H,1H3,(H2,7,8,10)
- InChI Key： FYAGLPZMTMNZMW-UHFFFAOYSA-N
- SMILES： OC1=C(C(NC=C1C)=O)O
Computed Properties
- Exact Mass: 141.042593085g/mol
- Monoisotopic Mass: 141.042593085g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 239
- 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: 69.6?2
Pyridinetriol, methyl- Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
95508-57-9 (Pyridinetriol, methyl-) Related Products
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