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(S)-Tenofovir

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Category Hepatitis B Virus (HBV)
CAS 147127-19-3
Description One isomer impurity of Tenofovir, which is an acyclic phosphonate nucleotide derivative, could be used in antiviral treatment as an everse transcriptase inhibitor.
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Product Information

Synonyms (S)-(((1-(6-Amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)phosphonic acid
IUPAC Name [(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid
Molecular Weight 287.22
Molecular Formula C9H14N5O4P
Canonical SMILES CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O
InChI InChI=1S/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1
InChIKey SGOIRFVFHAKUTI-LURJTMIESA-N
Boiling Point 616.1°C at 760mmHg
Melting Point >260 °C
Flash Point 326.4°C
Purity > 95%
Density 1.79g/cm3
Solubility In vitro:
10 mM in DMSO
Appearance White to off-white crystalline powder or powder
Storage Powder:
-20°C: 3 years
4°C: 2 years
In solvent:
-80°C: 6 months
-20°C: 1 month
Complexity 354
Exact Mass 287.07834094
Index Of Refraction 1.739
PSA 146.19000
Target HIV; HBV
Vapor Pressure 4.92E-16mmHg at 25°C
XLogP3-AA -1.6

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