Cas no 53761-31-2 (2,4(1H,3H)-Pyrimidinedione,5-(2-hydroxypropyl)-)
53761-31-2 structure
Product Name:2,4(1H,3H)-Pyrimidinedione,5-(2-hydroxypropyl)-
CAS No:53761-31-2
MF:C7H10N2O3
MW:170.165901660919
CID:380781
PubChem ID:299875
Update Time:2025-04-19
2,4(1H,3H)-Pyrimidinedione,5-(2-hydroxypropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(1H,3H)-Pyrimidinedione,5-(2-hydroxypropyl)-
- 5-(2-hydroxypropyl)-1H-pyrimidine-2,4-dione
- 5-(2-Hydroxy-2-methylethyl)uracil
- 5-(2-hydroxypropyl)-1H,3H-pyrimidine-2,4-dione
- 5-(2-hydroxy-propyl)-1H-pyrimidine-2,4-dione
- 5-(2-hydroxypropyl)pyrimidine-2,4(1H,3H)-dione
- AC1L6V8Z
- NSC173722
- DTXSID40306033
- NSC-173722
- 53761-31-2
-
- Inchi: 1S/C7H10N2O3/c1-4(10)2-5-3-8-7(12)9-6(5)11/h3-4,10H,2H2,1H3,(H2,8,9,11,12)
- InChI Key: ZSKJDRZQWNMCPC-UHFFFAOYSA-N
- SMILES: OC(C)CC1=CNC(NC1=O)=O
Computed Properties
- Exact Mass: 170.0692
- Monoisotopic Mass: 170.06914219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 247
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1
- Topological Polar Surface Area: 78.4?2
Experimental Properties
- PSA: 78.43
- LogP: -1.01350
2,4(1H,3H)-Pyrimidinedione,5-(2-hydroxypropyl)- Related Literature
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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