Cas no 84478-38-6 (4-chloro-2-fluoro-5-(propan-2-yloxy)aniline)
84478-38-6 structure
Product Name:4-chloro-2-fluoro-5-(propan-2-yloxy)aniline
CAS No:84478-38-6
MF:C9H11ClFNO
MW:203.641144990921
CID:1823887
PubChem ID:158649
Update Time:2025-04-21
4-chloro-2-fluoro-5-(propan-2-yloxy)aniline Chemical and Physical Properties
Names and Identifiers
-
- 4-chloro-2-fluoro-5-(propan-2-yloxy)aniline
- Benzenamine, 4-chloro-2-fluoro-5-(1-methylethoxy)-
- 4-chloro-2-fluoro-5-(1-methylethoxy)-Benzenamine
- DTXSID80233455
- GEGKRSHJWVPCPA-UHFFFAOYSA-N
- 84478-38-6
- SCHEMBL4678114
- 4-Chloro-2-fluoro-5-(1 -methylethoxy)aniline
- 4-chloro-2-fluoro-5-isopropoxy-aniline
- 4-Chloro-2-fluoro-5-isopropyloxyaniline
- 2-fluoro-4-chloro-5-isopropoxyaniline
- 4-chloro-2-fluoro-5-(1-methylethoxy)aniline
- CS-0380712
- 4-chloro-2-fluoro-5-isopropoxyaniline
-
- Inchi： 1S/C9H11ClFNO/c1-5(2)13-9-4-8(12)7(11)3-6(9)10/h3-5H,12H2,1-2H3
- InChI Key： GEGKRSHJWVPCPA-UHFFFAOYSA-N
- SMILES： ClC1=CC(=C(C=C1OC(C)C)N)F
Computed Properties
- Exact Mass: 203.0513198g/mol
- Monoisotopic Mass: 203.0513198g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 168
- 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: 2.7
- Topological Polar Surface Area: 35.2?2
4-chloro-2-fluoro-5-(propan-2-yloxy)aniline Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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