Cas no 873335-99-0 (1-Propanone, 1-phenyl-2-(3-thienyl)-)
873335-99-0 structure
Product Name:1-Propanone, 1-phenyl-2-(3-thienyl)-
CAS No:873335-99-0
MF:C13H12OS
MW:216.298782348633
CID:1883883
PubChem ID:57354998
Update Time:2025-04-21
1-Propanone, 1-phenyl-2-(3-thienyl)- Chemical and Physical Properties
Names and Identifiers
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- 1-Propanone, 1-phenyl-2-(3-thienyl)-
- 1-phenyl-2-thiophen-3-ylpropan-1-one
- 1-Phenyl-2-(thiophen-3-yl)propan-1-one
- 873335-99-0
- DTXSID50722826
- DTXCID00673571
-
- Inchi： 1S/C13H12OS/c1-10(12-7-8-15-9-12)13(14)11-5-3-2-4-6-11/h2-10H,1H3
- InChI Key： IAHNFQYFPIRIES-UHFFFAOYSA-N
- SMILES： S1C=CC(=C1)C(C)C(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 216.06088618g/mol
- 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: 221
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 45.3?2
1-Propanone, 1-phenyl-2-(3-thienyl)- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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