Cas no 100750-82-1 (2-Thiopheneacetylchloride, a-oxo-5-propyl-)
100750-82-1 structure
Product Name:2-Thiopheneacetylchloride, a-oxo-5-propyl-
CAS No:100750-82-1
MF:C9H9ClO2S
MW:216.684560537338
CID:124218
PubChem ID:45081144
Update Time:2025-04-18
2-Thiopheneacetylchloride, a-oxo-5-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiopheneacetylchloride, a-oxo-5-propyl-
- 2-oxo-2-(5-propylthiophen-2-yl)acetyl chloride
- 2-Thiopheneacetyl chloride, alpha-oxo-5-propyl- (9CI)
- DTXSID90664392
- Oxo(5-propylthiophen-2-yl)acetyl chloride
- 100750-82-1
- 2-THIOPHENEACETYL CHLORIDE,A-OXO-5-PROPYL-
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- Inchi： 1S/C9H9ClO2S/c1-2-3-6-4-5-7(13-6)8(11)9(10)12/h4-5H,2-3H2,1H3
- InChI Key： PESFSGNWWMWHNW-UHFFFAOYSA-N
- SMILES： ClC(C(C1=CC=C(CCC)S1)=O)=O
Computed Properties
- Exact Mass: 216.00127
- Monoisotopic Mass: 216.001
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 218
- 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
- Topological Polar Surface Area: 62.4A^2
- XLogP3: 3.5
Experimental Properties
- PSA: 34.14
- LogP: 2.64870
2-Thiopheneacetylchloride, a-oxo-5-propyl- Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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M. A. Piechowiak,A. Videcoq,R. Ferrando,D. Bochicchio,C. Pagnoux,F. Rossignol Phys. Chem. Chem. Phys., 2012,14, 1431-1439
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
100750-82-1 (2-Thiopheneacetylchloride, a-oxo-5-propyl-) Related Products
- 326-91-0(2-Thenoyltrifluoroacetone)
- 22720-75-8(2-Acetylbenzothiophene)
- 6193-47-1(cyclopropyl(thiophen-2-yl)methanone)
- 88-15-3(2-Acetylthiophene)
- 4066-41-5(5-Acetylthiophene-2-carboxylic acid)
- 13679-74-8(2-Acetyl-5-methylthiophene)
- 13679-72-6(2-Acetyl-3-methylthiophene)
- 4075-59-6(α-oxo-2-Thiopheneacetic Acid)
- 5650-52-2(4,5-dihydrocyclopenta[b]thiophen-6-one)
- 13679-75-9(1-(2-Thienyl)-1-propanone)
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