Cas no 16652-03-2 (Benzenemethanaminium,N,N,N-triethyl-)
16652-03-2 structure
Product Name:Benzenemethanaminium,N,N,N-triethyl-
Benzenemethanaminium,N,N,N-triethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanaminium,N,N,N-triethyl-
- benzyl(triethyl)azanium
- benzyl-triethyl-azanium
- Ammonium, benzyltriethyl-
- N-benzyl-N,N-diethylethanaminium
- Triethylbenzylammonium
- UNII-QS1AQC1A39
- VBQDSLGFSUGBBE-UHFFFAOYSA-N
- BENZYLTRIETHYLAMMONIUM CATION
- CHEMBL1231492
- InChI=1/C13H22N/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3/q+
- 2q9y
- SCHEMBL81238
- Q27287469
- AKOS024455954
- BENZYLTRIETHYLAMMONIUM ION
- NS00013405
- 16652-03-2
- benzyltriethylammonium
- A8091
- BENZYLTRIETHYLAZANIUM
- DTXSID40168118
- Benzenemethanaminium, N,N,N-triethyl-
- QS1AQC1A39
- benzyl triethylammonium
-
- Inchi： 1S/C13H22N/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3/q+1
- InChI Key： VBQDSLGFSUGBBE-UHFFFAOYSA-N
- SMILES： [N+](CC)(CC)(CC)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 192.17536
- Monoisotopic Mass: 192.175
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 135
- 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: 0A^2
- XLogP3: 2.9
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 0
Benzenemethanaminium,N,N,N-triethyl- Related Literature
-
Weichen Wang,Juanli Zhu,Gang Tang,Hong Huo,Wenbing Zhang,You Liang,Hongqiang Dong,Jiale Yang,Yongsong Cao New J. Chem. 2019 43 827
-
Raquel F.M. Frade,Andreia A. Rosatella,Carolina S. Marques,Luis C. Branco,Prashant S. Kulkarni,Nuno M. M. Mateus,Carlos A. M. Afonso,Catarina M.M. Duarte Green Chem. 2009 11 1660
-
Amrutha P. Thankachan,K. S. Sindhu,K. Keerthi Krishnan,Gopinathan Anilkumar Org. Biomol. Chem. 2015 13 8780
-
Oleg I. Artyushin,Ekaterina V. Matveeva,Anna V. Vologzhanina,Yan Z. Voloshin Dalton Trans. 2016 45 5328
-
Yang Wang,Lijuan Liu,Pan Chen,Lina Zhang,Ang Lu Phys. Chem. Chem. Phys. 2018 20 14223
16652-03-2 (Benzenemethanaminium,N,N,N-triethyl-) Related Products
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