Cas no 94196-28-8 (1,4-Benzenediamine,N1,N1-dioctyl-)
94196-28-8 structure
Product Name:1,4-Benzenediamine,N1,N1-dioctyl-
1,4-Benzenediamine,N1,N1-dioctyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine,N1,N1-dioctyl-
- 4-N,4-N-dioctylbenzene-1,4-diamine
- N'-dioctyl-p-phenylenediamine
- N~1~,N~1~-Dioctylbenzene-1,4-diamine
- SCHEMBL294502
- 94196-28-8
- DTXSID50916203
-
- Inchi: 1S/C22H40N2/c1-3-5-7-9-11-13-19-24(20-14-12-10-8-6-4-2)22-17-15-21(23)16-18-22/h15-18H,3-14,19-20,23H2,1-2H3
- InChI Key: CKMBEBRHYZPOJI-UHFFFAOYSA-N
- SMILES: N(C1C=CC(=CC=1)N)(CCCCCCCC)CCCCCCCC
Computed Properties
- Exact Mass: 332.319
- Monoisotopic Mass: 332.319
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 15
- Complexity: 243
- 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: 8.2
- Topological Polar Surface Area: 29.3?2
Experimental Properties
- Density: 0.921
- Boiling Point: 454.9°Cat760mmHg
- Flash Point: 220.4°C
- Refractive Index: 1.519
1,4-Benzenediamine,N1,N1-dioctyl- Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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