Cas no 36368-79-3 (1-Hexanaminium, N,N,N-trihexyl-, acetate)
36368-79-3 structure
Product Name:1-Hexanaminium, N,N,N-trihexyl-, acetate
CAS No:36368-79-3
MF:C26H55NO2
MW:413.720408678055
CID:1478833
PubChem ID:21869009
Update Time:2025-04-21
1-Hexanaminium, N,N,N-trihexyl-, acetate Chemical and Physical Properties
Names and Identifiers
-
- 1-Hexanaminium, N,N,N-trihexyl-, acetate
- tetrahexylazanium,acetate
- SCHEMBL635372
- 36368-79-3
- DTXSID30619129
- N,N,N-Trihexylhexan-1-aminium acetate
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- Inchi： 1S/C24H52N.C2H4O2/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;1-2(3)4/h5-24H2,1-4H3;1H3,(H,3,4)/q+1;/p-1
- InChI Key： OVEGCWNSHIHZJK-UHFFFAOYSA-M
- SMILES： [O-]C(C)=O.[N+](CCCCCC)(CCCCCC)(CCCCCC)CCCCCC
Computed Properties
- Exact Mass: 413.42355
- Monoisotopic Mass: 413.42328000g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 20
- Complexity: 221
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.1?2
Experimental Properties
- PSA: 40.13
1-Hexanaminium, N,N,N-trihexyl-, acetate Related Literature
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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2. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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