Cas no 53404-48-1 (Tris(2-hydroxyethyl)ammonium 2-(2,4-dichlorophenoxy)propionate)
53404-48-1 structure
Product Name:Tris(2-hydroxyethyl)ammonium 2-(2,4-dichlorophenoxy)propionate
CAS No:53404-48-1
MF:C15H23Cl2NO6
MW:384.25222325325
CID:377659
Update Time:2024-01-29
Tris(2-hydroxyethyl)ammonium 2-(2,4-dichlorophenoxy)propionate Chemical and Physical Properties
Names and Identifiers
-
- Tris(2-hydroxyethyl)ammonium 2-(2,4-dichlorophenoxy)propionate
- 2-(2,4-Dichlorophenoxy)propanoic acid - 2,2',2''-nitrilotriethano l (1:1)
- 1-Dodecanaminium, N,N-didodecyl-N-methyl-, carbonate (2:1)
- ACMC-20m7xf
- AGN-PC-01M3CO
- CTK0G5777
- tridodecylmethylammonium carbonate
- triethanolamine (+-)-2-(2,4-dichlorophenoxy)-propionic acid
-
- Inchi： 1S/C9H8Cl2O3.C6H15NO3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11;8-4-1-7(2-5-9)3-6-10/h2-5H,1H3,(H,12,13);8-10H,1-6H2
- InChI Key： BMMYGCZONMRMGA-UHFFFAOYSA-N
- SMILES： [NH+](CCO)(CCO)CCO.C([O-])(=O)C(OC1=CC=C(Cl)C=C1Cl)C
Computed Properties
- Exact Mass: 383.09039
- Monoisotopic Mass: 383.090243
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 24
- Rotatable Bond Count: 9
- Complexity: 266
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 111
Experimental Properties
- Boiling Point: 348.3°Cat760mmHg
- Flash Point: 164.5°C
- PSA: 114.49
Tris(2-hydroxyethyl)ammonium 2-(2,4-dichlorophenoxy)propionate Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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