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2-Fluoroadenosine

CAT: 0931-T7981-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T7981-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
146-78-1
Target
Antibacterial, Others
Related Pathways
Others, Microbiology/Virology
Purity
0.9967
Bioactivity
2-Fluoroadenosine is a potent inhibitor of lymphocyte-mediated cytolysis.
Smiles
NC1=C2C(N(C=N2)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)=NC(F)=N1
Molecular Formula
C10H12FN5O4
Molecular Weight
285.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Fluoroadenosine

2-fluoroadenosine is a member of adenosines and an organofluorine compound.

CAS Number146-78-1
PubChem CID8975
IUPAC Name(2R,3R,4S,5R)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Molecular FormulaC10H12FN5O4
Molecular Weight285.23
XLogP-0.6
Topological Polar Surface Area140
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity367
SMILES
C1=NC2=C(N=C(N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)F)N
InChI
InChI=1S/C10H12FN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)/t3-,5-,6-,9-/m1/s1
InChIKey
HBUBKKRHXORPQB-UUOKFMHZSA-N
Chemical Structure
2D Structure
2D structure of 2-Fluoroadenosine
CAS: 146-78-1
CID: 8975
Formula: C10H12FN5O4
MW: 285.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight285.23
XLogP3-0.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Exact Mass285.08733204
Monoisotopic Mass285.08733204
Topological Polar Surface Area140 Ų
Heavy Atom Count20
Formal Charge0
Complexity367
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes