Cas no 66191-47-7 (2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)-)
66191-47-7 structure
Product Name:2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)-
CAS No:66191-47-7
MF:C6H7BrN2O2
MW:219.035980463028
CID:396700
PubChem ID:3272339
Update Time:2025-04-19
2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)-
- 1-(2-bromoethyl)pyrimidine-2,4-dione
- SCHEMBL16632410
- AKOS005607620
- 2-(1-uracilyl)ethyl bromide
- 1-(2-bromoethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
- 66191-47-7
- 1-(2-bromoethyl)pyrimidine-2,4(1H,3H)-dione
- DTXSID90390902
-
- Inchi： 1S/C6H7BrN2O2/c7-2-4-9-3-1-5(10)8-6(9)11/h1,3H,2,4H2,(H,8,10,11)
- InChI Key： GLESWWBHBSDOLZ-UHFFFAOYSA-N
- SMILES： BrCCN1C=CC(NC1=O)=O
Computed Properties
- Exact Mass: 217.96911
- Monoisotopic Mass: 217.96909g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 215
- 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
- Topological Polar Surface Area: 49.4?2
Experimental Properties
- PSA: 49.41
2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)- Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
66191-47-7 (2,4(1H,3H)-Pyrimidinedione, 1-(2-bromoethyl)-) Related Products
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