Cas no 82162-09-2 (Benzene,trimethylpropyl-)
Benzene,trimethylpropyl- structure
Product Name:Benzene,trimethylpropyl-
Benzene,trimethylpropyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,trimethylpropyl-
- 1,2,3-trimethyl-4-propylbenzene
- SZAIENRDRCMPRX-UHFFFAOYSA-N
- 1,2,3-Trimethyl-4-n-Propylbenzene
- trimethylpropylbenzene
- Benzene, trimethylpropyl-
- Benzene, 1,2,3-trimethyl-4-propyl
- 82162-09-2
- DTXSID00231599
-
- Inchi： 1S/C12H18/c1-5-6-12-8-7-9(2)10(3)11(12)4/h7-8H,5-6H2,1-4H3
- InChI Key： SZAIENRDRCMPRX-UHFFFAOYSA-N
- SMILES： C1(C=CC(C)=C(C)C=1C)CCC
Computed Properties
- Exact Mass: 162.140850574g/mol
- Monoisotopic Mass: 162.140850574g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 128
- 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
- Topological Polar Surface Area: 0?2
Benzene,trimethylpropyl- Related Literature
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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