Cas no 66587-69-7 (1-(4,5-dimethylthiophen-2-yl)ethanone)
66587-69-7 structure
Product Name:1-(4,5-dimethylthiophen-2-yl)ethanone
CAS No:66587-69-7
MF:C8H10OS
MW:154.229401111603
CID:964234
PubChem ID:298612
Update Time:2025-04-19
1-(4,5-dimethylthiophen-2-yl)ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-(4,5-dimethylthiophen-2-yl)ethanone
- 1-(4,5-dimethyl-2-thienyl)Ethanone
- (4,5-dimethyl-2-thienyl)(methyl)methanone
- 1-(4,5-Dimethyl-[2]thienyl)-aethanon
- 1-(4,5-dimethyl-[2]thienyl)-ethanone
- 2-acetyl-4,5-dimethylthiophene
- 4,5-Dimethyl-2-acetothienon
- 5-Acetyl-2,3-dimethylthiophene
- AC1L6TDN
- CTK5J9908
- NSC170826
- SureCN5850753
- OANYJDXGTCXYAT-UHFFFAOYSA-N
- FT-0740226
- Ethanone,5-dimethyl-2-thienyl)-
- 66587-69-7
- DTXSID00305461
- (4,5-dimethyl-2-thienyl)(methyl) methanone
- AKOS005167000
- NSC-170826
- SCHEMBL5850753
- DB-073773
-
- Inchi： 1S/C8H10OS/c1-5-4-8(6(2)9)10-7(5)3/h4H,1-3H3
- InChI Key： OANYJDXGTCXYAT-UHFFFAOYSA-N
- SMILES： S1C(C(C)=O)=CC(C)=C1C
Computed Properties
- Exact Mass: 154.0453
- Monoisotopic Mass: 154.04523611g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 144
- 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: 2.4
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 17.07
1-(4,5-dimethylthiophen-2-yl)ethanone Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
66587-69-7 (1-(4,5-dimethylthiophen-2-yl)ethanone) Related Products
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