Cas no 69365-70-4 (N,N,N-trimethyl-2-phenylpropan-1-aminium iodide)
69365-70-4 structure
Product Name:N,N,N-trimethyl-2-phenylpropan-1-aminium iodide
CAS No:69365-70-4
MF:C12H20IN
MW:305.198375701904
CID:1735325
PubChem ID:50459
Update Time:2025-04-21
N,N,N-trimethyl-2-phenylpropan-1-aminium iodide Chemical and Physical Properties
Names and Identifiers
-
- N,N,N-trimethyl-2-phenylpropan-1-aminium iodide
- trimethyl(2-phenylpropyl)azanium,iodide
- beta-Phenylpropyl-trimethylammonium iodide
- DTXSID00989129
- Trimethyl(beta-methylphenethyl)ammonium iodide
- AMMONIUM, TRIMETHYL(beta-METHYLPHENETHYL)-, IODIDE
- beta-Methylphenethyl-trimethylammonium iodide
- trimethyl(2-phenylpropyl)azanium;iodide
- 69365-70-4
-
- Inchi： 1S/C12H20N.HI/c1-11(10-13(2,3)4)12-8-6-5-7-9-12;/h5-9,11H,10H2,1-4H3;1H/q+1;/p-1
- InChI Key： ZREHXCRFIOLDJR-UHFFFAOYSA-M
- SMILES： [I-].[N+](C)(C)(C)CC(C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 284.9071
- Monoisotopic Mass: 305.06405g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 140
- 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: 0?2
Experimental Properties
- PSA: 0
N,N,N-trimethyl-2-phenylpropan-1-aminium iodide Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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