Cas no 84478-78-4 (Benzene, 1-chloro-2-ethoxy-5-fluoro-4-nitro-)
84478-78-4 structure
Product Name:Benzene, 1-chloro-2-ethoxy-5-fluoro-4-nitro-
CAS No:84478-78-4
MF:C8H7ClFNO3
MW:219.597484827042
CID:4214943
PubChem ID:13281434
Update Time:2025-04-24
Benzene, 1-chloro-2-ethoxy-5-fluoro-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-chloro-2-ethoxy-5-fluoro-4-nitro-
- 84478-78-4
- 1-Chloro-2-ethoxy-5-fluoro-4-nitrobenzene
- DTXSID301272457
-
- Inchi： 1S/C8H7ClFNO3/c1-2-14-8-4-7(11(12)13)6(10)3-5(8)9/h3-4H,2H2,1H3
- InChI Key： QFULTYSUJQJCOG-UHFFFAOYSA-N
- SMILES： ClC1=CC(=C(C=C1OCC)[N+](=O)[O-])F
Computed Properties
- Exact Mass: 219.0098489g/mol
- Monoisotopic Mass: 219.0098489g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 211
- 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: 2.8
- Topological Polar Surface Area: 55?2
Benzene, 1-chloro-2-ethoxy-5-fluoro-4-nitro- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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