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Emtricitabine Impurity 43

CAT: 1299-RM-E201843-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-E201843-01Size:10 mg
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CAS Number
144371-00-6
Synonyms
4-amino-5-fluoro-1- (2- (hydroxymethyl) -1,3-oxathiolan-5-yl) pyrimidin-2 (1H) -one
Molecular Formula
C8H10FN3O3S
Molecular Weight
247.24
Target Alternative Name
Emtricitabine
Product Name Synonym
4-amino-5-fluoro-1- (2- (hydroxymethyl) -1,3-oxathiolan-5-yl) pyrimidin-2 (1H) -one

Chemical Information

Racivir

Racivir, also known as RCV, is an oxothiolane nucleoside reverse transcriptase inhibitor similar to emtricitabine and lamivudine. Racivir is a 50:50 mixture of [emtricitabine] and its positive enantiomer. Racivir has been used in trials studying the prevention of HIV Infections.

CAS Number144371-00-6
PubChem CID9837769
IUPAC Name4-amino-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one
Molecular FormulaC8H10FN3O3S
Molecular Weight247.25
XLogP-0.6
Topological Polar Surface Area113
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity374
SMILES
C1C(OC(S1)CO)N2C=C(C(=NC2=O)N)F
InChI
InChI=1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)
InChIKey
XQSPYNMVSIKCOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Racivir
CAS: 144371-00-6
CID: 9837769
Formula: C8H10FN3O3S
MW: 247.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.25
XLogP3-0.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass247.04269053
Monoisotopic Mass247.04269053
Topological Polar Surface Area113 Ų
Heavy Atom Count16
Formal Charge0
Complexity374
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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