6H-Purin-6-one, 9-β-D-arabinofuranosyl-2-fluoro-1,9-dihydro- supplier

Name
9--D-Arabinofuranosyl-2-fluoro-1,9-dihydro-6H-purin-6-one
EINECS
CAS No. 83480-48-2
Density 2.175 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁FN₄O₅
Boiling Point
Molecular Weight 286.22
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 9-β-D-Arabinofuranosyl-2-fluorohypoxanthine;9-β-D-Arabinofuranosyl-2-fluoro-1,9-dihydro-6H-purin-6-one;
PSA 133.49000
LogP -2.12980

6H-Purin-6-one, 9-β-D-arabinofuranosyl-2-fluoro-1,9-dihydro- Specification

The 6H-Purin-6-one, 9-β-D-arabinofuranosyl-2-fluoro-1,9-dihydro-, with the CAS registry number 83480-48-2, is also known as 9-β-D-Arabinofuranosyl-2-fluoro-1,9-dihydro-6H-purin-6-one. It belongs to the product categories of Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals. This chemical's molecular formula is C₁₀H₁₁FN₄O₅ and molecular weight is 286.22. What's more, its systematic name is 9-[(2R,3R,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-fluoro-1H-purin-6-one.

Physical properties of 6H-Purin-6-one, 9-β-D-arabinofuranosyl-2-fluoro-1,9-dihydro- are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 3.806; (5)ACD/KOC (pH 7.4): 1.938; (6)#H bond acceptors: 9; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 129.2 Å²; (10)Index of Refraction: 1.85; (11)Molar Refractivity: 58.767 cm³; (12)Molar Volume: 131.57 cm³; (13)Polarizability: 23.297×10^-24cm³; (14)Surface Tension: 95.673 dyne/cm; (15)Density: 2.175 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: c1nc2c(=O)[nH]c(nc2n1[C@H]3[C@@H](C([C@H](O3)CO)O)O)F
(2)InChI: InChI=1S/C10H11FN4O5/c11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H,13,14,19)/t3-,5?,6-,9-/m1/s1
(3)InChIKey: RHLSRGWIGPHHJW-VCXQEIDJSA-N

Product Name

9--D-Arabinofuranosyl-2-fluoro-1,9-dihydro-6H-purin-6-one

6H-Purin-6-one, 9-β-D-arabinofuranosyl-2-fluoro-1,9-dihydro- Specification

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