Cas no 413601-53-3 (2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI))
![2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI) structure](https://ossimg.kuujia.com/scimg/414000/413601-53-3x500.png)
413601-53-3 structure
Product Name:2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI)
CAS No:413601-53-3
MF:C7H17NO3
MW:163.214782476425
CID:926902
PubChem ID:6951551
Update Time:2025-04-19
2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI) Chemical and Physical Properties
Names and Identifiers
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- 2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI)
- (S)-2,2'-((2-Hydroxypropyl)azanediyl)diethanol
- 413601-53-3
- SCHEMBL20994688
- 10.14272/ZFECCYLNALETDE-ZETCQYMHSA-N.1
- doi:10.14272/ZFECCYLNALETDE-ZETCQYMHSA-N.1
-
- Inchi： 1S/C7H17NO3/c1-7(11)6-8(2-4-9)3-5-10/h7,9-11H,2-6H2,1H3/t7-/m0/s1
- InChI Key： ZFECCYLNALETDE-ZETCQYMHSA-N
- SMILES： O[C@@H](C)CN(CCO)CCO
Computed Properties
- Exact Mass: 163.12084340g/mol
- Monoisotopic Mass: 163.12084340g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 83.8
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.4
- Topological Polar Surface Area: 63.9?2
2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI) Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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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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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
413601-53-3 (2-Propanol,1-[bis(2-hydroxyethyl)amino]-,(2S)-(9CI)) Related Products
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