Cas no 77966-81-5 (N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride)
![N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride structure](https://ossimg.kuujia.com/scimg/78000/77966-81-5x500.png)
77966-81-5 structure
Product Name:N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride
CAS No:77966-81-5
MF:C17H31Cl2N3O
MW:364.353542566299
CID:1790301
PubChem ID:53950
Update Time:2025-04-21
N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride Chemical and Physical Properties
Names and Identifiers
-
- N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride
- 2-(diethylazaniumyl)ethyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium,dichloride
- 2-(2-(Diethylamino)ethyl)methylamino-2',6'-acetoxylidide dihydrochloride
- C 5342
- 77966-81-5
- 2',6'-ACETOXYLIDIDE, 2-(2-(DIETHYLAMINO)ETHYL)METHYLAMINO-, DIHYDROCHLORIDE
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- Inchi： 1S/C17H29N3O.2ClH/c1-6-20(7-2)12-11-19(5)13-16(21)18-17-14(3)9-8-10-15(17)4;;/h8-10H,6-7,11-13H2,1-5H3,(H,18,21);2*1H
- InChI Key： AGCRUJJXPAKCSA-UHFFFAOYSA-N
- SMILES： [Cl-].[Cl-].O=C(C[NH+](C)CC[NH+](CC)CC)NC1C(C)=CC=CC=1C
Computed Properties
- Exact Mass: 363.184418
- Monoisotopic Mass: 363.184418
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 8
- Complexity: 294
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 38
Experimental Properties
- Boiling Point: 402.9°C at 760 mmHg
- Flash Point: 197.5°C
N-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-N',N'-diethyl-N-methylethane-1,2-diaminium dichloride Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Mei Zhang,Jingjing Guo,Tingting Liu,Zhanyu He,Majeed Irfan,Zujin Zhao,Zhuo Zeng J. Mater. Chem. C, 2020,8, 14919-14924
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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