Cas no 5543-89-5 (1,4-Benzenediamine, N-ethyl-N-phenyl-)
5543-89-5 structure
Product Name:1,4-Benzenediamine, N-ethyl-N-phenyl-
CAS No:5543-89-5
MF:C14H16N2
MW:212.290243148804
CID:351939
PubChem ID:10878483
Update Time:2025-04-19
1,4-Benzenediamine, N-ethyl-N-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine, N-ethyl-N-phenyl-
- 4-N-ethyl-4-N-phenylbenzene-1,4-diamine
- DTXSID20446840
- 5543-89-5
- SCHEMBL5843310
- AKOS000146783
-
- Inchi: 1S/C14H16N2/c1-2-16(13-6-4-3-5-7-13)14-10-8-12(15)9-11-14/h3-11H,2,15H2,1H3
- InChI Key: HIWOQWICOFGBEQ-UHFFFAOYSA-N
- SMILES: N(C1C=CC=CC=1)(C1C=CC(=CC=1)N)CC
Computed Properties
- Exact Mass: 212.13148
- Monoisotopic Mass: 212.131348519g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 191
- 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: 3.8
- Topological Polar Surface Area: 29.3?2
Experimental Properties
- PSA: 29.26
1,4-Benzenediamine, N-ethyl-N-phenyl- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
N. Soin,D. Boyer,K. Prashanthi,S. Sharma,A. A. Narasimulu,J. Luo,T. H. Shah,E. Siores,T. Thundat Chem. Commun., 2015,51, 8257-8260
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