Cas no 28360-96-5 (Adenosine,2-fluoro-N,N-dimethyl- (8CI))
28360-96-5 structure
Product Name:Adenosine,2-fluoro-N,N-dimethyl- (8CI)
CAS No:28360-96-5
MF:C12H16FN5O4
MW:313.284945487976
CID:286520
PubChem ID:276229
Update Time:2025-04-19
Adenosine,2-fluoro-N,N-dimethyl- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- Adenosine,2-fluoro-N,N-dimethyl- (8CI)
- 28360-96-5
- NSC-123798
- DTXSID90298510
- NSC123798
- 2-fluoro-n,n-dimethyl-9-pentofuranosyl-9h-purin-6-amine
-
- Inchi： 1S/C12H16FN5O4/c1-17(2)9-6-10(16-12(13)15-9)18(4-14-6)11-8(21)7(20)5(3-19)22-11/h4-5,7-8,11,19-21H,3H2,1-2H3
- InChI Key： OAAKTTXSIFEAQY-UHFFFAOYSA-N
- SMILES： FC1N=C(C2=C(N=1)N(C=N2)C1C(C(C(CO)O1)O)O)N(C)C
Computed Properties
- Exact Mass: 313.119
- Monoisotopic Mass: 313.119
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- 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: 117?2
Experimental Properties
- Density: 1.78
- Boiling Point: 663°C at 760 mmHg
- Flash Point: 354.8°C
- Refractive Index: 1.739
- PSA: 116.76000
- LogP: -1.35710
Adenosine,2-fluoro-N,N-dimethyl- (8CI) Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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