Cas no 61413-47-6 (Ethanol, 2-[(aminomethyl)amino]-)
![Ethanol, 2-[(aminomethyl)amino]- structure](https://ossimg.kuujia.com/scimg/61500/61413-47-6x500.png)
61413-47-6 structure
Product Name:Ethanol, 2-[(aminomethyl)amino]-
CAS No:61413-47-6
MF:C3H10N2O
MW:90.1243004798889
CID:480442
PubChem ID:20220642
Update Time:2025-04-19
Ethanol, 2-[(aminomethyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol, 2-[(aminomethyl)amino]-
- 2-(aminomethylamino)ethanol
- DTXSID10603743
- 61413-47-6
- 2-[(Aminomethyl)amino]ethan-1-ol
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- Inchi： 1S/C3H10N2O/c4-3-5-1-2-6/h5-6H,1-4H2
- InChI Key： NWTYCFFQLWYXHG-UHFFFAOYSA-N
- SMILES： OCCNCN
Computed Properties
- Exact Mass: 90.0794
- Monoisotopic Mass: 90.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 6
- Rotatable Bond Count: 3
- Complexity: 24.8
- 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: -1.7
- Topological Polar Surface Area: 58.3?2
Experimental Properties
- PSA: 58.28
Ethanol, 2-[(aminomethyl)amino]- Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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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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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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