ChemicalBook--->CAS DataBase List--->21679-12-9

21679-12-9

21679-12-9 Structure

21679-12-9 Structure
IdentificationBack Directory
[Name]

2'-DEOXY-2-FLUOROADENOSINE
[CAS]

21679-12-9
[Synonyms]

NSC 114093
2-Fluorodeoxyadenosine
Metronidazole Impurity 19
2'-DEOXY-2-FLUOROADENOSINE
2-Fluoro-2'-deoxyadenosine 96%
(2R,3S,5R)-5-(6-Amino-2-fluoro-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
[EINECS(EC#)]

633-655-1
[Molecular Formula]

C10H12FN5O3
[MDL Number]

MFCD03411337
[MOL File]

21679-12-9.mol
[Molecular Weight]

269.23
Chemical PropertiesBack Directory
[Melting point ]

218 °C (dec.)
[storage temp. ]

2-8°C, sealed storage, away from moisture and light
[form ]

crystals
[color ]

White to off-white
[Optical Rotation]

[α]20/D -16°, c = 1 in methanol
[InChI]

1S/C10H12FN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5+,6+/m0/s1
[InChIKey]

ZWPYUXAXLRFWQC-KVQBGUIXSA-N
[SMILES]

Nc1nc(F)nc2n(cnc12)[C@H]3C[C@H](O)[C@@H](CO)O3
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2934999090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

2-Fluoro-2’-deoxyadenosine is an analog tested to the susceptibility of clinical metronidazole-resistant Trichomonas vaginalis. Also, it is one of two purine nucleoside that forms a suicide system as a powerful killing and bystander effects on tumor cells.
[Definition]

ChEBI: 2'-deoxy-2-fluoroadenosine is a member of adenosines and an organofluorine compound.
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