Cas no 502760-08-9 (Decane, 2-bromo-2-methyl-)
Decane, 2-bromo-2-methyl- structure
Product Name:Decane, 2-bromo-2-methyl-
CAS No:502760-08-9
MF:C11H23Br
MW:235.20432305336
CID:365398
PubChem ID:12030651
Update Time:2025-04-19
Decane, 2-bromo-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Decane, 2-bromo-2-methyl-
- 2-bromo-2-methyldecane
- 502760-08-9
- DTXSID20476107
-
- Inchi： 1S/C11H23Br/c1-4-5-6-7-8-9-10-11(2,3)12/h4-10H2,1-3H3
- InChI Key： VPHRQYBYTFDBOA-UHFFFAOYSA-N
- SMILES： BrC(C)(C)CCCCCCCC
Computed Properties
- Exact Mass: 234.09839
- Monoisotopic Mass: 234.09831g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 7
- Complexity: 97.2
- 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: 5.6
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Decane, 2-bromo-2-methyl- Related Literature
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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Julia M. Yeomans Soft Matter, 2010,6, 703-704
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