Cas no 28221-81-0 (Ethanone,1,1'-(2,5-benzofurandiyl)bis- (9CI))
28221-81-0 structure
Product Name:Ethanone,1,1'-(2,5-benzofurandiyl)bis- (9CI)
CAS No:28221-81-0
MF:C12H10O3
MW:202.206003665924
CID:273191
PubChem ID:317197
Update Time:2025-04-19
Ethanone,1,1'-(2,5-benzofurandiyl)bis- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1,1'-(2,5-benzofurandiyl)bis- (9CI)
- 1-(2-acetyl-1-benzofuran-5-yl)ethanone
- 1,1'-benzofuran-2,5-diyl-bis-ethanone
- 2-Acetyl-5-acetylbenzofuran
- AC1L7VGK
- Benzofuran,5-diacetyl-
- CTK8H9921
- Ethanone,1'-(2,5-benzofurandiyl)bis-
- NSC247532
- NSC-247532
- 1,1'-(1-Benzofuran-2,5-diyl)di(ethan-1-one)
- DTXSID60311927
- SCHEMBL15623111
- 28221-81-0
-
- Inchi： 1S/C12H10O3/c1-7(13)9-3-4-11-10(5-9)6-12(15-11)8(2)14/h3-6H,1-2H3
- InChI Key： QKNUQRIOFNUYQG-UHFFFAOYSA-N
- SMILES： O1C(C(C)=O)=CC2C=C(C(C)=O)C=CC1=2
Computed Properties
- Exact Mass: 202.063
- Monoisotopic Mass: 202.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 285
- 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
- Topological Polar Surface Area: 47.3?2
Experimental Properties
- Density: 1.193
- Boiling Point: 333.4°C at 760 mmHg
- Flash Point: 155.3°C
- Refractive Index: 1.58
- PSA: 47.28
- LogP: 2.83800
Ethanone,1,1'-(2,5-benzofurandiyl)bis- (9CI) Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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