Cas no 7030-60-6 (1,2-Ethanediamine,N,N'-bis(3-methylphenyl)- (9CI))
7030-60-6 structure
Product Name:1,2-Ethanediamine,N,N'-bis(3-methylphenyl)- (9CI)
1,2-Ethanediamine,N,N'-bis(3-methylphenyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 1,2-Ethanediamine,N,N'-bis(3-methylphenyl)- (9CI)
- N,N'-bis(3-methylphenyl)ethane-1,2-diamine
- N,N'-ethylenedi-m-toluidine
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- Inchi： 1S/C16H20N2/c1-13-5-3-7-15(11-13)17-9-10-18-16-8-4-6-14(2)12-16/h3-8,11-12,17-18H,9-10H2,1-2H3
- InChI Key： WXEZZUDLDARSKV-UHFFFAOYSA-N
- SMILES： N(C1C=CC=C(C)C=1)CCNC1C=CC=C(C)C=1
Computed Properties
- Exact Mass: 240.1628
- Monoisotopic Mass: 240.162649
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 205
- 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
- Topological Polar Surface Area: 24.1
- XLogP3: 4.3
Experimental Properties
- Density: 1.083
- Boiling Point: 436°C at 760 mmHg
- Flash Point: 279.1°C
- Refractive Index: 1.634
- PSA: 24.06
1,2-Ethanediamine,N,N'-bis(3-methylphenyl)- (9CI) Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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