Cas no 55265-55-9 (2,4(1H,3H)-Pyrimidinedione, 1,1'-(1,3-propanediyl)bis[3,5-dimethyl-)
55265-55-9 structure
Product Name:2,4(1H,3H)-Pyrimidinedione, 1,1'-(1,3-propanediyl)bis[3,5-dimethyl-
CAS No:55265-55-9
MF:C15H20N4O4
MW:320.343703269959
CID:352402
PubChem ID:71364252
Update Time:2025-04-19
2,4(1H,3H)-Pyrimidinedione, 1,1'-(1,3-propanediyl)bis[3,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-[3-(3,5-dimethyl-2,4-dioxopyrimidin-1-yl)propyl]-3,5-dimethylpyrimidine-2,4-dione
- SCHEMBL15125556
- DTXSID30787731
- 1,1'-(Propane-1,3-diyl)bis(3,5-dimethylpyrimidine-2,4(1H,3H)-dione)
- 55265-55-9
- 2,4(1H,3H)-Pyrimidinedione, 1,1'-(1,3-propanediyl)bis[3,5-dimethyl-
-
- Inchi： 1S/C15H20N4O4/c1-10-8-18(14(22)16(3)12(10)20)6-5-7-19-9-11(2)13(21)17(4)15(19)23/h8-9H,5-7H2,1-4H3
- InChI Key： PDTGMUUBYJBJIC-UHFFFAOYSA-N
- SMILES： O=C1N(C)C(C(C)=CN1CCCN1C=C(C)C(N(C)C1=O)=O)=O
Computed Properties
- Exact Mass: 320.1486
- Monoisotopic Mass: 320.14845513g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 583
- 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: -0.3
- Topological Polar Surface Area: 81.2?2
Experimental Properties
- PSA: 81.24
2,4(1H,3H)-Pyrimidinedione, 1,1'-(1,3-propanediyl)bis[3,5-dimethyl- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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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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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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