Cas no 55053-79-7 (1,1'-[ethane-1,2-diylbis(methylimino)]bis(3-phenoxypropan-2-ol) dihydrochloride)
55053-79-7 structure
Product Name:1,1'-[ethane-1,2-diylbis(methylimino)]bis(3-phenoxypropan-2-ol) dihydrochloride
CAS No:55053-79-7
MF:C22H34Cl2N2O4
MW:461.422364711761
CID:1591752
PubChem ID:191358
Update Time:2025-04-21
1,1'-[ethane-1,2-diylbis(methylimino)]bis(3-phenoxypropan-2-ol) dihydrochloride Chemical and Physical Properties
Names and Identifiers
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- 1,1'-[ethane-1,2-diylbis(methylimino)]bis(3-phenoxypropan-2-ol) dihydrochloride
- 1-[2-[(2-hydroxy-3-phenoxypropyl)-methylamino]ethyl-methylamino]-3-phenoxypropan-2-ol,dihydrochloride
- 1,1'-[Ethane-1,2-diylbis(methylazanediyl)]bis(3-phenoxypropan-2-ol)--hydrogen chloride (1/2)
- DTXSID00970411
- 55053-79-7
- Rom 205
- 1,1'-(1,2-Ethanediylbis(methylimino))bis(3-phenoxy-2-propanol, dihydrochloride
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- Inchi: 1S/C22H32N2O4.2ClH/c1-23(15-19(25)17-27-21-9-5-3-6-10-21)13-14-24(2)16-20(26)18-28-22-11-7-4-8-12-22;;/h3-12,19-20,25-26H,13-18H2,1-2H3;2*1H
- InChI Key: FTGYKWAHGPIJIT-UHFFFAOYSA-N
- SMILES: Cl.Cl.OC(COC1C=CC=CC=1)CN(C)CCN(C)CC(COC1C=CC=CC=1)O
Computed Properties
- Exact Mass: 460.18982
- Monoisotopic Mass: 460.1895630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 30
- Rotatable Bond Count: 13
- Complexity: 351
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 65.4?2
Experimental Properties
- PSA: 65.4
1,1'-[ethane-1,2-diylbis(methylimino)]bis(3-phenoxypropan-2-ol) dihydrochloride Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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