Cas no 110051-71-3 (p-Toluenesulfonamide, a,a'-(ethylenediimino)bis[N,N-dimethyl-, dihydrochloride(6CI))
110051-71-3 structure
Product Name:p-Toluenesulfonamide, a,a'-(ethylenediimino)bis[N,N-dimethyl-, dihydrochloride(6CI)
CAS No:110051-71-3
MF:C20H32Cl2N4O4S2
MW:527.528480529785
CID:190701
PubChem ID:3066339
Update Time:2025-04-19
p-Toluenesulfonamide, a,a'-(ethylenediimino)bis[N,N-dimethyl-, dihydrochloride(6CI) Chemical and Physical Properties
Names and Identifiers
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- 4-[[2-[[4-(dimethylsulfamoyl)phenyl]methylamino]ethylamino]methyl]-N,N-dimethylbenzenesulfonamide,dihydrochloride
- 110051-71-3
- alpha,beta-Bis(paradimethylamido-sulphonobenzylamino)-ethane dihydrochloride
- p-Toluenesulfonamide, alpha,alpha'-(ethylenediimino)bis(N,N-dimethyl-, dihydrochloride
- alpha,alpha'-(Ethylenediimino)bis(N,N-dimethyl-p-toluenesulfonamide) dihydrochloride
- DTXSID50149130
- p-Toluenesulfonamide, a,a'-(ethylenediimino)bis[N,N-dimethyl-, dihydrochloride(6CI)
-
- Inchi： 1S/C20H30N4O4S2.2ClH/c1-23(2)29(25,26)19-9-5-17(6-10-19)15-21-13-14-22-16-18-7-11-20(12-8-18)30(27,28)24(3)4;;/h5-12,21-22H,13-16H2,1-4H3;2*1H
- InChI Key： UJAUSGHNUJLVLB-UHFFFAOYSA-N
- SMILES： Cl.Cl.S(C1C=CC(=CC=1)CNCCNCC1C=CC(=CC=1)S(N(C)C)(=O)=O)(N(C)C)(=O)=O
Computed Properties
- Exact Mass: 526.12456
- Monoisotopic Mass: 526.1242032g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 32
- Rotatable Bond Count: 11
- Complexity: 636
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 98.82
p-Toluenesulfonamide, a,a'-(ethylenediimino)bis[N,N-dimethyl-, dihydrochloride(6CI) Related Literature
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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