Cas no 900174-84-7 (Benzene, 1-ethoxy-4-fluoro-5-iodo-2-methoxy-)
900174-84-7 structure
Product Name:Benzene, 1-ethoxy-4-fluoro-5-iodo-2-methoxy-
CAS No:900174-84-7
MF:C9H10FIO2
MW:296.077378749847
CID:796369
PubChem ID:59838060
Update Time:2025-04-19
Benzene, 1-ethoxy-4-fluoro-5-iodo-2-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-ethoxy-4-fluoro-5-iodo-2-methoxy-
- 1-ethoxy-4-fluoro-5-iodo-2-methoxybenzene
- 1-Ethoxy4-fluoro-5-iodo-2-methoxybenzene
- SCHEMBL2911033
- 900174-84-7
- DTXSID00733184
- VVYOTTZNQZLJPW-UHFFFAOYSA-N
-
- Inchi： 1S/C9H10FIO2/c1-3-13-9-5-7(11)6(10)4-8(9)12-2/h4-5H,3H2,1-2H3
- InChI Key： VVYOTTZNQZLJPW-UHFFFAOYSA-N
- SMILES： IC1C(=CC(=C(C=1)OCC)OC)F
Computed Properties
- Exact Mass: 295.97096g/mol
- Monoisotopic Mass: 295.97096g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 157
- 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
- Topological Polar Surface Area: 18.5?2
Benzene, 1-ethoxy-4-fluoro-5-iodo-2-methoxy- Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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