Cas no 13732-80-4 (toluene, 3,4-diethyl-)
toluene, 3,4-diethyl- structure
Product Name:toluene, 3,4-diethyl-
toluene, 3,4-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- toluene, 3,4-diethyl-
- 1,2-DIETHYL-4-METHYLBENZENE
- 1-Methyl-3,4-diethylbenzene
- Benzene, 3,4-diethyl-1-methyl
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- Inchi： 1S/C11H16/c1-4-10-7-6-9(3)8-11(10)5-2/h6-8H,4-5H2,1-3H3
- InChI Key： MJQJAQGFUBIGIK-UHFFFAOYSA-N
- SMILES： C1(C=C(C)C=CC=1CC)CC
Computed Properties
- Exact Mass: 148.12528
- Monoisotopic Mass: 148.125200510g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 107
- 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: 3.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
toluene, 3,4-diethyl- Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
13732-80-4 (toluene, 3,4-diethyl-) Related Products
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