Cas no 1227588-24-0 (4-(Difluoromethoxy)-2-nitro-1-(trifluoromethyl)benzene)
1227588-24-0 structure
Product Name:4-(Difluoromethoxy)-2-nitro-1-(trifluoromethyl)benzene
CAS No:1227588-24-0
MF:C8H4F5NO3
MW:257.114279747009
CID:1073896
PubChem ID:71669510
Update Time:2025-04-20
4-(Difluoromethoxy)-2-nitro-1-(trifluoromethyl)benzene Chemical and Physical Properties
Names and Identifiers
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- 4-(Difluoromethoxy)-2-nitro-1-(trifluoromethyl)benzene
- AKOS016016480
- 1227588-24-0
-
- MDL： MFCD16606439
- Inchi： 1S/C8H4F5NO3/c9-7(10)17-4-1-2-5(8(11,12)13)6(3-4)14(15)16/h1-3,7H
- InChI Key： GVXBMRAPMUUKPQ-UHFFFAOYSA-N
- SMILES： FC(C1C=CC(=CC=1[N+](=O)[O-])OC(F)F)(F)F
Computed Properties
- Exact Mass: 257.01113380g/mol
- Monoisotopic Mass: 257.01113380g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 277
- 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: 3.6
- Topological Polar Surface Area: 55?2
4-(Difluoromethoxy)-2-nitro-1-(trifluoromethyl)benzene Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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