Cas no 5103-93-5 (Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)-)
5103-93-5 structure
Product Name:Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)-
CAS No:5103-93-5
MF:C13H12F3N3O4
MW:331.24729347229
CID:385416
PubChem ID:20503006
Update Time:2025-04-19
Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)-
- 2,6-dinitro-N,N-bis(prop-2-enyl)-4-(trifluoromethyl)aniline
- Allylfluralin
- Benzenamine, 2,6-dinitro-N,N-di-2-propenyl-4-(trifluoromethyl)- (9CI)
- p-Toluidine,N,N-diallyl-a,a,a-trifluoro-2,6-dinitro- (7CI,8CI)
- DTXSID70608198
- 5103-93-5
- SCHEMBL11201388
- 2,6-Dinitro-N,N-di(prop-2-en-1-yl)-4-(trifluoromethyl)aniline
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- Inchi： 1S/C13H12F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h3-4,7-8H,1-2,5-6H2
- InChI Key： GZOXUTHKNRHGST-UHFFFAOYSA-N
- SMILES： FC(C1C=C(C(=C(C=1)[N+](=O)[O-])N(CC=C)CC=C)[N+](=O)[O-])(F)F
Computed Properties
- Exact Mass: 331.07806
- Monoisotopic Mass: 331.07799036g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 23
- Rotatable Bond Count: 5
- Complexity: 439
- 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
- XLogP3: 4.8
- Topological Polar Surface Area: 94.9?2
Experimental Properties
- PSA: 89.52
Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
5103-93-5 (Benzenamine, 2,6-dinitro-N,N-di-2-propen-1-yl-4-(trifluoromethyl)-) Related Products
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