Cas no 54107-52-7 (1-phenyl-2-thioxo-4-Imidazolidinone)
54107-52-7 structure
Product Name:1-phenyl-2-thioxo-4-Imidazolidinone
CAS No:54107-52-7
MF:C9H8N2OS
MW:192.237620353699
CID:1113653
PubChem ID:5090721
Update Time:2025-04-20
1-phenyl-2-thioxo-4-Imidazolidinone Chemical and Physical Properties
Names and Identifiers
-
- 1-phenyl-2-thioxo-4-Imidazolidinone
- 1-phenyl-2-sulfanylideneimidazolidin-4-one
- AKOS002783884
- SCHEMBL62942
- PQMRRAQXKWFYQN-UHFFFAOYSA-N
- 4-Imidazolidinone, 1-phenyl-2-thioxo-
- DTXSID30408217
- 1-Phenyl-2-thioxo-4-imidazolidinone #
- 54107-52-7
- AG-690/36644044
- NS00083737
- 1-phenyl-2-thioxoimidazolidin-4-one
-
- Inchi： 1S/C9H8N2OS/c12-8-6-11(9(13)10-8)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,12,13)
- InChI Key： PQMRRAQXKWFYQN-UHFFFAOYSA-N
- SMILES： S=C1NC(CN1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 192.03573406g/mol
- Monoisotopic Mass: 192.03573406g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 236
- 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: 1.3
- Topological Polar Surface Area: 64.4?2
1-phenyl-2-thioxo-4-Imidazolidinone Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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