Cas no 61579-10-0 (Ethanol, 2-[bis[2-(3-aminopropoxy)ethyl]amino]-)
61579-10-0 structure
Product Name:Ethanol, 2-[bis[2-(3-aminopropoxy)ethyl]amino]-
CAS No:61579-10-0
MF:C12H29N3O3
MW:263.376963376999
CID:474108
PubChem ID:20392114
Update Time:2025-04-19
Ethanol, 2-[bis[2-(3-aminopropoxy)ethyl]amino]- Chemical and Physical Properties
Names and Identifiers
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- Ethanol, 2-[bis[2-(3-aminopropoxy)ethyl]amino]-
- 2-[bis[2-(3-aminopropoxy)ethyl]amino]ethanol
- 2-{Bis[2-(3-aminopropoxy)ethyl]amino}ethan-1-ol
- DTXSID40606606
- 61579-10-0
- SCHEMBL11528074
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- Inchi: 1S/C12H29N3O3/c13-3-1-9-17-11-6-15(5-8-16)7-12-18-10-2-4-14/h16H,1-14H2
- InChI Key: QXGHTDSRDKLSJM-UHFFFAOYSA-N
- SMILES: O(CCCN)CCN(CCO)CCOCCCN
Computed Properties
- Exact Mass: 263.22107
- Monoisotopic Mass: 263.22089180g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 14
- Complexity: 148
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.9
- Topological Polar Surface Area: 94?2
Experimental Properties
- PSA: 93.97
Ethanol, 2-[bis[2-(3-aminopropoxy)ethyl]amino]- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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