Cas no 79780-68-0 (4-Ethyl-2,3-dihydro-1H-inden-1-one)
79780-68-0 structure
Product Name:4-Ethyl-2,3-dihydro-1H-inden-1-one
CAS No:79780-68-0
MF:C11H12O
MW:160.212383270264
CID:2187389
Update Time:2023-08-05
4-Ethyl-2,3-dihydro-1H-inden-1-one Chemical and Physical Properties
Names and Identifiers
-
- 4-Ethyl-2,3-dihydro-1h-inden-1-one
- 4-Ethylindanone
- 4-Ethylindan-1-one
- 4-ethyl-indan-1-one
- 1H-Inden-1-one, 4-ethyl-2,3-dihydro-
- UHRSBAQYOGCQKA-UHFFFAOYSA-N
- 2,3-dihydro-4-ethyl-1H-inden-1-one
- 4-Ethyl-2,3-dihydro-1H-inden-1-one
-
- Inchi： 1S/C11H12O/c1-2-8-4-3-5-10-9(8)6-7-11(10)12/h3-5H,2,6-7H2,1H3
- InChI Key： UHRSBAQYOGCQKA-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=C(CC)C=2CC1
Computed Properties
- Exact Mass: 160.089
- Monoisotopic Mass: 160.089
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 185
- 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: 17.1
4-Ethyl-2,3-dihydro-1H-inden-1-one Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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