Cas no 25517-05-9 (Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1))
![Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1) structure](https://ossimg.kuujia.com/scimg/26000/25517-05-9x500.png)
25517-05-9 structure
Product Name:Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1)
CAS No:25517-05-9
MF:C17H31IN2O
MW:406.34531712532
CID:267681
PubChem ID:64205
Update Time:2025-04-19
Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1)
- [2-(1-adamantylamino)-2-oxoethyl]-diethyl-methylazanium,iodide
- Ammonium, ((1-adamantylcarbamoyl)methyl)diethylmethyl-, iodide
- ((1-Adamantylcarbamoyl)methyl)diethylmethylammonium iodide
- 25517-05-9
- T 2236
-
- Inchi： 1S/C17H30N2O.HI/c1-4-19(3,5-2)12-16(20)18-17-9-13-6-14(10-17)8-15(7-13)11-17;/h13-15H,4-12H2,1-3H3;1H
- InChI Key： KDLLLGASDBRTQL-UHFFFAOYSA-N
- SMILES： [I-].O=C(C[N+](C)(CC)CC)NC12CC3CC(CC(C3)C1)C2
Computed Properties
- Exact Mass: 374.9051
- Monoisotopic Mass: 406.148107
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 345
- 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: 29.1
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 31.17
Ethanaminium,N,N-diethyl-N-methyl-2-oxo-2-(tricyclo[3.3.1.13,7]dec-1-ylamino)-, iodide (1:1) Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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