Cas no 52779-81-4 (Methanone,(4-ethylphenyl)-2-thienyl-)
52779-81-4 structure
Product Name:Methanone,(4-ethylphenyl)-2-thienyl-
CAS No:52779-81-4
MF:C13H12OS
MW:216.298782348633
CID:375703
PubChem ID:104321
Update Time:2025-04-19
Methanone,(4-ethylphenyl)-2-thienyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone,(4-ethylphenyl)-2-thienyl-
- (4-ethylphenyl)-thiophen-2-ylmethanone
- 4-ethylphenyl 2-thienyl ketone
- (4-ethylphenyl)(thiophen-2-yl)methanone
- AKOS009347532
- (4-ETHYLPHENYL)-2-THIENYLMETHANONE
- p-ethylphenyl 2-thienyl ketone
- decarboxysuprofen
- GODQIIKZEJTEPS-UHFFFAOYSA-N
- ZRQ94N8GVZ
- NS00032583
- Methanone, (4-ethylphenyl)-2-thienyl-
- UNII-ZRQ94N8GVZ
- (4-ethylphenyl)(2-thienyl)methanone
- Q27133392
- DTXSID30200758
- SCHEMBL1942718
- EINECS 258-170-9
- CHEBI:64707
- 52779-81-4
- 2-(p-ethylbenzoyl)thiophene
- Epitope ID:167709
- (4-ETHYLPHENYL)-THIOPHEN-2-YL METHANONE
-
- Inchi： 1S/C13H12OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9H,2H2,1H3
- InChI Key： GODQIIKZEJTEPS-UHFFFAOYSA-N
- SMILES： S1C=CC=C1C(C1C=CC(=CC=1)CC)=O
Computed Properties
- Exact Mass: 216.06096
- Monoisotopic Mass: 216.06088618g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 219
- 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
- Surface Charge: 0
- Tautomer Count: 4
- XLogP3: 4.1
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 17.07
Methanone,(4-ethylphenyl)-2-thienyl- Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
52779-81-4 (Methanone,(4-ethylphenyl)-2-thienyl-) Related Products
- 135-00-2(2-Benzoylthiophene)
- 175136-70-6((2,3,4,5,6-Pentamethylphenyl)(thiophen-2-yl)methanone)
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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