Cas no 7253-52-3 ((5Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one)
7253-52-3 structure
Product Name:(5Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one
CAS No:7253-52-3
MF:C11H10N2O2S
MW:234.274301052094
CID:977302
PubChem ID:722749
Update Time:2025-04-19
(5Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one Chemical and Physical Properties
Names and Identifiers
-
- (5Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one
- (5Z)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
- 5-(4-methoxybenzylidene)-2-thioxo-4-imidazolidinone
- AC1LF48T
- AC1Q7FAK
- CHEMBL1956800
- MolPort-001-012-742
- NSC31154
- NSC684360
- STOCK1S-58730
- AKOS001024009
- 7253-52-3
- 4-Imidazolidinone, 5-((4-methoxyphenyl)methylene)-2-thioxo-
- (Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one
- 5-((4-Methoxyphenyl)methylene)-2-thioxo-4-imidazolidinone
- Hydantoin, 5-(p-methoxybenzylidene)-2-thio-
- MLS002639391
- (5Z)-5-[(4-methoxyphenyl)methylene]-2-thioxo-imidazolidin-4-one
- NSC-684360
- NSC-31154
- SCHEMBL15421317
- SR-01000389889
- SCHEMBL15421319
- 4-Imidazolidinone, 5-[(4-methoxyphenyl)methylene]-2-thioxo-, (5Z)-
- 95474-45-6
- SR-01000389889-1
- NSC 31154
-
- Inchi： 1S/C11H10N2O2S/c1-15-8-4-2-7(3-5-8)6-9-10(14)13-11(16)12-9/h2-6H,1H3,(H2,12,13,14,16)/b9-6-
- InChI Key： XNQUYEHNKGAJNI-TWGQIWQCSA-N
- SMILES： S=C1NC(/C(=C/C2C=CC(=CC=2)OC)/N1)=O
Computed Properties
- Exact Mass: 234.04600
- Monoisotopic Mass: 234.046
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 333
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 82.4?2
Experimental Properties
- Density: 1.37
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.672
- PSA: 82.45000
- LogP: 1.69800
(5Z)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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