Cas no 6314-55-2 (N-ethyl-N-(4-nitrobenzyl)ethanamine)
6314-55-2 structure
Product Name:N-ethyl-N-(4-nitrobenzyl)ethanamine
CAS No:6314-55-2
MF:C11H17ClN2O2
MW:244.717881917953
CID:958835
PubChem ID:92007137
Update Time:2025-04-19
N-ethyl-N-(4-nitrobenzyl)ethanamine Chemical and Physical Properties
Names and Identifiers
-
- N-ethyl-N-(4-nitrobenzyl)ethanamine
- N-ethyl-N-[(4-nitrophenyl)methyl]ethanamine
- AC1L93I6
- AG-G-33600
- CTK5B7775
- N,N-Diethyl-p-nitrobenzylamine
- SureCN3157181
- N-ethyl-N-(4-nitrobenzyl)ethanaminehydrochloride
- N-ethyl-N-[(4-nitrophenyl)methyl]ethanamine;hydrochloride
- N-ethyl-N-(4-nitrobenzyl)ethanamine hydrochloride
- 6314-55-2
-
- Inchi: 1S/C11H16N2O2.ClH/c1-3-12(4-2)9-10-5-7-11(8-6-10)13(14)15;/h5-8H,3-4,9H2,1-2H3;1H
- InChI Key: BJNBYVXPHQXRBJ-UHFFFAOYSA-N
- SMILES: Cl.[O-][N+](C1C=CC(=CC=1)CN(CC)CC)=O
Computed Properties
- Exact Mass: 208.12128
- Monoisotopic Mass: 243.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 191
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.1A^2
Experimental Properties
- Density: 1.091
- Boiling Point: 296.2°C at 760 mmHg
- Flash Point: 132.9°C
- Refractive Index: 1.54
- PSA: 46.38
- LogP: -0.03620
N-ethyl-N-(4-nitrobenzyl)ethanamine Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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