Cas no 89471-54-5 (Cyclohexane, 1-(2-bromo-1-methylethyl)-3-methyl-)
89471-54-5 structure
Product Name:Cyclohexane, 1-(2-bromo-1-methylethyl)-3-methyl-
CAS No:89471-54-5
MF:C10H19Br
MW:219.161862611771
CID:599475
PubChem ID:14263709
Update Time:2025-04-19
Cyclohexane, 1-(2-bromo-1-methylethyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexane, 1-(2-bromo-1-methylethyl)-3-methyl-
- 1-(1-bromopropan-2-yl)-3-methylcyclohexane
- 89471-54-5
- DTXSID50558142
-
- Inchi： 1S/C10H19Br/c1-8-4-3-5-10(6-8)9(2)7-11/h8-10H,3-7H2,1-2H3
- InChI Key： UNVHUZLCFOYKHW-UHFFFAOYSA-N
- SMILES： BrCC(C)C1CCCC(C)C1
Computed Properties
- Exact Mass: 218.06701g/mol
- Monoisotopic Mass: 218.06701g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 111
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.8
- Topological Polar Surface Area: 0?2
Cyclohexane, 1-(2-bromo-1-methylethyl)-3-methyl- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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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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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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