Cas no 70942-03-9 (N,N-bis(2-hydroxyethyl)pentanamide)
70942-03-9 structure
Product Name:N,N-bis(2-hydroxyethyl)pentanamide
CAS No:70942-03-9
MF:C9H19NO3
MW:189.252063035965
CID:1747410
PubChem ID:116940
Update Time:2025-04-21
N,N-bis(2-hydroxyethyl)pentanamide Chemical and Physical Properties
Names and Identifiers
-
- N,N-bis(2-hydroxyethyl)pentanamide
- N,N-Bis(2-hydroxyethyl)valeramide
- pentanamide, N,N-bis(2-hydroxyethyl)-
- 70942-03-9
- SCHEMBL8626869
- DTXSID5072199
- AKOS010485644
- RBYBLKRMFXJVST-UHFFFAOYSA-N
-
- Inchi： 1S/C9H19NO3/c1-2-3-4-9(13)10(5-7-11)6-8-12/h11-12H,2-8H2,1H3
- InChI Key： RBYBLKRMFXJVST-UHFFFAOYSA-N
- SMILES： O=C(CCCC)N(CCO)CCO
Computed Properties
- Exact Mass: 189.13657
- Monoisotopic Mass: 189.13649347g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 133
- 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: -0.3
- Topological Polar Surface Area: 60.8?2
Experimental Properties
- PSA: 60.77
N,N-bis(2-hydroxyethyl)pentanamide Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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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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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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