Cas no 459218-68-9 (4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI))
![4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI) structure](https://ossimg.kuujia.com/scimg/459500/459218-68-9x500.png)
459218-68-9 structure
Product Name:4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI)
CAS No:459218-68-9
MF:C6H9N3O2
MW:155.154560804367
CID:1020901
PubChem ID:2069277
Update Time:2025-04-20
4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI)
- 459218-68-9
- DB-272060
- 2-((2-Hydroxyethyl)amino)pyrimidin-4-ol
- 4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]-
- SCHEMBL18615429
-
- Inchi： 1S/C6H9N3O2/c10-4-3-8-6-7-2-1-5(11)9-6/h1-2,10H,3-4H2,(H2,7,8,9,11)
- InChI Key： MDGVSMWYCPDCSP-UHFFFAOYSA-N
- SMILES： OCCNC1=NC=CC(N1)=O
Computed Properties
- Exact Mass: 155.069476538g/mol
- Monoisotopic Mass: 155.069476538g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 210
- 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: -1.6
- Topological Polar Surface Area: 73.7?2
4(1H)-Pyrimidinone, 2-[(2-hydroxyethyl)amino]- (9CI) Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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