Cas no 34654-85-8 (2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl-)
34654-85-8 structure
Product Name:2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl-
CAS No:34654-85-8
MF:C7H9ClN2O2
MW:188.611560583115
CID:2942918
PubChem ID:13296987
Update Time:2024-03-01
2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl- Chemical and Physical Properties
Names and Identifiers
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- 2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl-
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- Inchi： 1S/C7H9ClN2O2/c1-4-5(8)9(2)7(12)10(3)6(4)11/h1-3H3
- InChI Key： HRRKZXJGZGQLKO-UHFFFAOYSA-N
- SMILES： C1(=O)N(C)C(Cl)=C(C)C(=O)N1C
Computed Properties
- Exact Mass: 188.0352552g/mol
- Monoisotopic Mass: 188.0352552g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 285
- 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: 0.6
- Topological Polar Surface Area: 40.6?2
2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Bo Chen,Xiaotong Shen,Zhangfeng Luo,Di Cai,Changjing Chen,Changwei Zhang,Peiyong Qin,Hui Cao,Tianwei Tan RSC Adv., 2018,8, 25602-25610
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Danlei Xiang Nanoscale, 2021,13, 5497-5506
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Weixuan Zeng,Ouissam El Bakouri,Henrik Ottosson Chem. Sci., 2021,12, 6159-6171
34654-85-8 (2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3,5-trimethyl-) Related Products
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