Cas no 277323-14-5 (4-Bromo-1-isopropoxy-2-isopropylbenzene)
277323-14-5 structure
Product Name:4-Bromo-1-isopropoxy-2-isopropylbenzene
CAS No:277323-14-5
MF:C12H17BrO
MW:257.166783094406
CID:2123973
Update Time:2023-08-04
4-Bromo-1-isopropoxy-2-isopropylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 4-bromo-1-isopropoxy-2-isopropylbenzene
- 4-bromo-2-(propan-2-yl)-1-(propan-2-yloxy)benzene
- 4-Bromo-1-isopropoxy-2-isopropylbenzene
-
- Inchi： 1S/C12H17BrO/c1-8(2)11-7-10(13)5-6-12(11)14-9(3)4/h5-9H,1-4H3
- InChI Key： OBDKGODWTSCXQC-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)C(C)C)OC(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 168
- Topological Polar Surface Area: 9.2
4-Bromo-1-isopropoxy-2-isopropylbenzene Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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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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