Cas no 921609-31-6 (Ethanone, 1-(2,3-difluoro-6-hydroxyphenyl)-)
921609-31-6 structure
Product Name:Ethanone, 1-(2,3-difluoro-6-hydroxyphenyl)-
CAS No:921609-31-6
MF:C8H6F2O2
MW:172.128849506378
CID:744153
PubChem ID:66991756
Update Time:2025-04-19
Ethanone, 1-(2,3-difluoro-6-hydroxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(2,3-difluoro-6-hydroxyphenyl)-
- 1-(2,3-difluoro-6-hydroxyphenyl)ethanone
- DTXSID30736163
- 921609-31-6
- SCHEMBL1320844
- 1-(2,3-Difluoro-6-hydroxyphenyl)ethan-1-one
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- Inchi： 1S/C8H6F2O2/c1-4(11)7-6(12)3-2-5(9)8(7)10/h2-3,12H,1H3
- InChI Key： XHVFNKVLITZGMV-UHFFFAOYSA-N
- SMILES： FC1=C(C=CC(=C1C(C)=O)O)F
Computed Properties
- Exact Mass: 172.03358575g/mol
- Monoisotopic Mass: 172.03358575g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 184
- 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: 37.3?2
Ethanone, 1-(2,3-difluoro-6-hydroxyphenyl)- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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