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2-Fluoroadenine

CAT: 0013-GTR19173492-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19173492-01Size:1 ml x 10 mM (in DMSO)
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Description
2-Fluoroadenine
CAS Number
700-49-2
Product Name Alternative
Cytotoxicity, DNA/RNA Synthesis, DNA Synthesis, DNASynthesis, CEM, Anticancer, 2 Fluoroadenine, 2Fluoroadenine, 2-Fluoroadenine, MRC-5, inhibit, NSC 27364, NSC27364, NSC-27364, Inhibitor, RNA Synthesis, RNASynthesis, Purine bases
Field of Research
Cell Biology, Molecular Biology
Purity
98.84% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (6.53 mM) ; DMSO:4.4 mg/mL (28.74 mM)
Smiles
NC1=C2NC=NC2=NC (F) =N1
Molecular Formula
C5H4FN5
Molecular Weight
153.12
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Fluoroadenine

2-fluoroadenine is an organofluorine compound that is adenine in which the hydrogen at position 2 (the carbon between the two nitrogens of the pyrimidine ring) is replaced by a fluorine. It has a role as an antineoplastic agent. It is a member of purines and an organofluorine compound.

CAS Number700-49-2
PubChem CID12790
IUPAC Name2-fluoro-7H-purin-6-amine
Molecular FormulaC5H4FN5
Molecular Weight153.12
XLogP-0.1
Topological Polar Surface Area80.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity154
SMILES
C1=NC2=NC(=NC(=C2N1)N)F
InChI
InChI=1S/C5H4FN5/c6-5-10-3(7)2-4(11-5)9-1-8-2/h1H,(H3,7,8,9,10,11)
InChIKey
WKMPTBDYDNUJLF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Fluoroadenine
CAS: 700-49-2
CID: 12790
Formula: C5H4FN5
MW: 153.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight153.12
XLogP3-0.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass153.04507331
Monoisotopic Mass153.04507331
Topological Polar Surface Area80.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity154
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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