Cas no 23589-14-2 (Adenosine,N-(2-ethoxyethyl)- (8CI,9CI))
23589-14-2 structure
Product Name:Adenosine,N-(2-ethoxyethyl)- (8CI,9CI)
CAS No:23589-14-2
MF:C14H21N5O5
MW:339.347042798996
CID:263239
PubChem ID:274745
Update Time:2025-04-19
Adenosine,N-(2-ethoxyethyl)- (8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Adenosine,N-(2-ethoxyethyl)- (8CI,9CI)
- NSC-120955
- DTXSID80946391
- 23589-14-2
- N-(2-Ethoxyethyl)-9-pentofuranosyl-9H-purin-6-aminato
- NSC120955
-
- Inchi： 1S/C14H21N5O5/c1-2-23-4-3-15-12-9-13(17-6-16-12)19(7-18-9)14-11(22)10(21)8(5-20)24-14/h6-8,10-11,14,20-22H,2-5H2,1H3,(H,15,16,17)
- InChI Key： BWAGUBKWKODPIO-UHFFFAOYSA-N
- SMILES： O1C(CO)C(C(C1N1C=NC2C(=NC=NC1=2)NCCOCC)O)O
Computed Properties
- Exact Mass: 339.15443
- Monoisotopic Mass: 339.15426879g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 24
- Rotatable Bond Count: 7
- Complexity: 406
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 135?2
Experimental Properties
- PSA: 134.78
- LogP: -1.04080
Adenosine,N-(2-ethoxyethyl)- (8CI,9CI) Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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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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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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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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