Cas no 921611-70-3 (Acetic acid, 2-(2,3-difluoro-6-nitrophenoxy)-, ethyl ester)
921611-70-3 structure
Product Name:Acetic acid, 2-(2,3-difluoro-6-nitrophenoxy)-, ethyl ester
CAS No:921611-70-3
MF:C10H9F2NO5
MW:261.178970098495
CID:744085
PubChem ID:71422182
Update Time:2025-04-19
Acetic acid, 2-(2,3-difluoro-6-nitrophenoxy)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Acetic acid, 2-(2,3-difluoro-6-nitrophenoxy)-, ethyl ester
- ethyl 2-(2,3-difluoro-6-nitrophenoxy)acetate
- Ethyl (2,3-difluoro-6-nitrophenoxy)acetate
- 921611-70-3
- DTXSID70841220
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- Inchi： 1S/C10H9F2NO5/c1-2-17-8(14)5-18-10-7(13(15)16)4-3-6(11)9(10)12/h3-4H,2,5H2,1H3
- InChI Key： YBBCXVKXTJIPDL-UHFFFAOYSA-N
- SMILES： FC1=C(C=CC(=C1OCC(=O)OCC)[N+](=O)[O-])F
Computed Properties
- Exact Mass: 261.04487871g/mol
- Monoisotopic Mass: 261.04487871g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 309
- 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: 2.2
- Topological Polar Surface Area: 81.4?2
Acetic acid, 2-(2,3-difluoro-6-nitrophenoxy)-, ethyl ester Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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