Cas no 5578-21-2 (1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene)
![1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene structure](https://ossimg.kuujia.com/scimg/6000/5578-21-2x500.png)
5578-21-2 structure
Product Name:1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene
CAS No:5578-21-2
MF:C16H17FO3
MW:276.302788496017
CID:1595572
PubChem ID:2251751
Update Time:2025-04-21
1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene Chemical and Physical Properties
Names and Identifiers
-
- 1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene
- 5578-21-2
- AB00090042-01
- Cambridge id 5578212
- DTXSID30367274
-
- Inchi： 1S/C16H17FO3/c1-18-13-6-4-7-14(12-13)19-10-5-11-20-16-9-3-2-8-15(16)17/h2-4,6-9,12H,5,10-11H2,1H3
- InChI Key： RGRBGJGXWFKFAE-UHFFFAOYSA-N
- SMILES： FC1C=CC=CC=1OCCCOC1C=CC=C(C=1)OC
Computed Properties
- Exact Mass: 276.11621
- Monoisotopic Mass: 276.116
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 262
- 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: 4
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- Density: 1.136
- Boiling Point: 388.6°C at 760 mmHg
- Flash Point: 197.4°C
- Refractive Index: 1.53
- PSA: 27.69
1-fluoro-2-[3-(3-methoxyphenoxy)propoxy]benzene Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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