Cas no 89807-77-2 (Benzenamine, 4-(2-methyl-3-phenylpropyl)-)
89807-77-2 structure
Product Name:Benzenamine, 4-(2-methyl-3-phenylpropyl)-
CAS No:89807-77-2
MF:C16H19N
MW:225.328764200211
CID:588673
PubChem ID:13630649
Update Time:2025-04-19
Benzenamine, 4-(2-methyl-3-phenylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 4-(2-methyl-3-phenylpropyl)-
- 4-(2-methyl-3-phenylpropyl)aniline
- 89807-77-2
- DTXSID60545447
-
- Inchi： 1S/C16H19N/c1-13(11-14-5-3-2-4-6-14)12-15-7-9-16(17)10-8-15/h2-10,13H,11-12,17H2,1H3
- InChI Key： ITVCTASRPXFYTP-UHFFFAOYSA-N
- SMILES： NC1C=CC(=CC=1)CC(C)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 225.151749610g/mol
- Monoisotopic Mass: 225.151749610g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 200
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 26?2
Benzenamine, 4-(2-methyl-3-phenylpropyl)- Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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