Cas no 16713-13-6 (Benzene, methyl-,labeled with tritium (9CI))
16713-13-6 structure
Product Name:Benzene, methyl-,labeled with tritium (9CI)
Benzene, methyl-,labeled with tritium (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzene, methyl-,labeled with tritium (9CI)
- [3H]TOLUENE
- TOLUENE, [3H]
- tritiomethylbenzene
- Toluene,[3h]
- 16713-13-6
-
- Inchi： 1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i1T
- InChI Key： YXFVVABEGXRONW-CNRUNOGKSA-N
- SMILES： C1(C[3H])C=CC=CC=1
Computed Properties
- Exact Mass: 94.070824505g/mol
- Monoisotopic Mass: 94.070824505g/mol
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 42
- 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: 2.7
- Topological Polar Surface Area: 0?2
Benzene, methyl-,labeled with tritium (9CI) Related Literature
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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