Cas no 14608-13-0 (Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2))
![Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2) structure](https://ossimg.kuujia.com/scimg/15000/14608-13-0x500.png)
14608-13-0 structure
Product Name:Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2)
CAS No:14608-13-0
MF:C15H28Cl2N4O3
MW:383.313821792603
CID:172498
PubChem ID:167125
Update Time:2025-04-19
Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2) Chemical and Physical Properties
Names and Identifiers
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- Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2)
- 2-{[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino}ethanol dihydrochloride
- 2-[2-diethylaminoethyl-(4-methylamino-3-nitro-phenyl)amino]ethanol dihydrochloride
- 2-[N-[2-(diethylamino)ethyl]-4-(methylamino)-3-nitroanilino]ethanol,dihydrochloride
- DTXSID00163265
- 14608-13-0
- 2-[N-[2-(diethylamino)ethyl]-4-(methylamino)-3-nitroanilino]ethanol;dihydrochloride
- Ethanol, 2-(N-(2-(diethylamino)ethyl)-4-(methylamino)-3-nitroanilino)-, dihydrochloride
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- Inchi： 1S/C15H26N4O3.2ClH/c1-4-17(5-2)8-9-18(10-11-20)13-6-7-14(16-3)15(12-13)19(21)22;;/h6-7,12,16,20H,4-5,8-11H2,1-3H3;2*1H
- InChI Key： HZKJRXKCBIZDAW-UHFFFAOYSA-N
- SMILES： Cl.Cl.OCCN(C1C=CC(=C(C=1)[N+](=O)[O-])NC)CCN(CC)CC
Computed Properties
- Exact Mass: 382.15414
- Monoisotopic Mass: 382.1538462g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 9
- Complexity: 320
- 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: 84.6?2
Experimental Properties
- PSA: 81.88
Ethanol,2-[[2-(diethylamino)ethyl][4-(methylamino)-3-nitrophenyl]amino]-, hydrochloride(1:2) Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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