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Fluorouracil EP Impurity F

CAT: 1596-AR-F01747-01Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-F01747-01Size:50 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
56177-80-1
Synonyms
2-ethoxy-5-fluoropyrimidin-4 (1H) -one;2-Ethoxy-5-fluoro-4 (1H) -pyrimidinone; Ethoxy-5-fluoro-4 (3H) -pyrimidinone
Molecular Formula
C6H7FN2O2
Molecular Weight
158.13
API Name
Fluorouracil

Chemical Information

2-Ethoxy-5-fluorouracil
CAS Number56177-80-1
PubChem CID92041
IUPAC Name2-ethoxy-5-fluoro-1H-pyrimidin-6-one
Molecular FormulaC6H7FN2O2
Molecular Weight158.13
XLogP0.4
Topological Polar Surface Area50.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity235
SMILES
CCOC1=NC=C(C(=O)N1)F
InChI
InChI=1S/C6H7FN2O2/c1-2-11-6-8-3-4(7)5(10)9-6/h3H,2H2,1H3,(H,8,9,10)
InChIKey
XREDGJFKPWBNRQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Ethoxy-5-fluorouracil
CAS: 56177-80-1
CID: 92041
Formula: C6H7FN2O2
MW: 158.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight158.13
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass158.04915563
Monoisotopic Mass158.04915563
Topological Polar Surface Area50.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity235
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