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5-FU (5-Fluorouracil)

CAT: 0957-S1209-1gSize: 1 gDry Ice: YesHazardous: No
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CAT#:0957-S1209-1gSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
51-21-8
Synonyms
Fluorouracil, NSC 19893
Target
DNA/RNA Synthesis
Applications
Cell Cycle
Smiles
C1=C (C (=O) NC (=O) N1) F
Molecular Formula
C4H3FN2O2
Additionnal Information
5-FU (5-Fluorouracil) is a DNA/RNA synthesis inhibitor, which interrupts nucleotide synthetic by inhibiting thymidylate synthase (TS) in tumor cells. Fluorouracil induces apoptosis and can be used in the treatment of HIV.
Storage Conditions
2 years -80 in solvent

Chemical Information

5-Fluorouracil

Fluorouracil can cause developmental toxicity according to an independent committee of scientific and health experts.

CAS Number51-21-8
PubChem CID3385
IUPAC Name5-fluoro-1H-pyrimidine-2,4-dione
Molecular FormulaC4H3FN2O2
Molecular Weight130.08
XLogP-0.9
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity199
SMILES
C1=C(C(=O)NC(=O)N1)F
InChI
InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
InChIKey
GHASVSINZRGABV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Fluorouracil
CAS: 51-21-8
CID: 3385
Formula: C4H3FN2O2
MW: 130.08
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight130.08
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass130.01785550
Monoisotopic Mass130.01785550
Topological Polar Surface Area58.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity199
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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