Cas no 79072-75-6 (Ethanamine, 2-(2-(4-chlorophenoxy)ethoxy)-N,N-dimethyl-, hydrochloride)
79072-75-6 structure
Product Name:Ethanamine, 2-(2-(4-chlorophenoxy)ethoxy)-N,N-dimethyl-, hydrochloride
CAS No:79072-75-6
MF:C12H19Cl2NO2
MW:280.190761804581
CID:564344
Update Time:2023-08-02
Ethanamine, 2-(2-(4-chlorophenoxy)ethoxy)-N,N-dimethyl-, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- Ethanamine,2-[2-(4-chlorophenoxy)ethoxy]-N,N-dimethyl-, hydrochloride (1:1)
- Ethanamine, 2-(2-(4-chlorophenoxy)ethoxy)-N,N-dimethyl-, hydrochloride
- neophenoxine
- N,N-Dimethylaminoethyl 4-chlorophenoxyethyl ether
- 2-[2-(4-Chlorophenoxy)ethoxy]-N,N-dimethylethan-1-amine--hydrogen chloride (1/1)
-
- Inchi： 1S/C12H18ClNO2.ClH/c1-14(2)7-8-15-9-10-16-12-5-3-11(13)4-6-12;/h3-6H,7-10H2,1-2H3;1H
- InChI Key： IQMKUBUNCZCVST-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)OCCOCCN(C)C.Cl
Computed Properties
- Exact Mass: 279.079
- Monoisotopic Mass: 279.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 170
- 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: 21.7
Experimental Properties
- Boiling Point: 325.8°C at 760 mmHg
- Flash Point: 150.8°C
Ethanamine, 2-(2-(4-chlorophenoxy)ethoxy)-N,N-dimethyl-, hydrochloride Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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