Cas no 61815-24-5 (4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-)
61815-24-5 structure
Product Name:4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-
CAS No:61815-24-5
MF:C12H14N2OS
MW:234.317361354828
CID:465415
PubChem ID:71391922
Update Time:2025-04-19
4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo- Chemical and Physical Properties
Names and Identifiers
-
- 4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-
- 5-ethyl-5-methyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
- 61815-24-5
- 5-Ethyl-5-methyl-3-phenyl-2-thioxoimidazolidin-4-one
- DTXSID70813745
-
- Inchi: 1S/C12H14N2OS/c1-3-12(2)10(15)14(11(16)13-12)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,13,16)
- InChI Key: MZYLEMCWTXNZPU-UHFFFAOYSA-N
- SMILES: S=C1N(C2C=CC=CC=2)C(C(C)(CC)N1)=O
Computed Properties
- Exact Mass: 234.08282
- Monoisotopic Mass: 234.08268425g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 312
- 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: 2.4
- Topological Polar Surface Area: 64.4?2
Experimental Properties
- PSA: 32.34
4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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