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24784-69-8

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Basic Information
CAS No.: 24784-69-8
Name: 6-FLUORO-9-BETA-D-RIBOFURANOSYL-9H-PURINE
Article Data: 3
Molecular Structure:
Molecular Structure of 24784-69-8 (6-FLUORO-9-BETA-D-RIBOFURANOSYL-9H-PURINE)
Formula: C10H11FN4O4
Molecular Weight: 270.22
Synonyms: 6-FLUORO-9-BETA-D-RIBOFURANOSYL-9H-PURINE;6-Fluoro-9-beta-D-ribofuranosylpurine;9H-Purine, 6-fluoro-9-beta-D-ribofuranosyl-
Density: 2.01 g/cm3
Boiling Point: 593.3 °C at 760 mmHg
Flash Point: 312.6 °C
PSA: 65.72000
LogP: -0.79770
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Specification

The 9H-Purine, 6-fluoro-9-β-D-ribofuranosyl- is an organic compound with the formula C10H11FN4O4. The IUPAC name of this chemical is (2R,3R,4S,5R)-2-(6-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol. With the CAS registry number 24784-69-8, it is also named as 6-Fluoro-9-β-d-ribofuranosylpurine.

Physical properties about 9H-Purine, 6-fluoro-9-β-D-ribofuranosyl- are: (1)ACD/LogP: -0.80; (2)#H bond acceptors: 8; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 80.52 Å2; (6)Index of Refraction: 1.809; (7)Molar Refractivity: 57.91 cm3; (8)Molar Volume: 134.2 cm3; (9)Polarizability: 22.95×10-24cm3; (10)Surface Tension: 83.4 dyne/cm; (11)Density: 2.01 g/cm3; (12)Flash Point: 312.6 °C; (13)Enthalpy of Vaporization: 93.03 kJ/mol; (14)Boiling Point: 593.3 °C at 760 mmHg; (15)Vapour Pressure: 6.39E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc3ncnc1c3ncn1[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)CO
(2)InChI: InChI=1/C10H11FN4O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2/t4-,6-,7-,10-/m1/s1
(3)InChIKey: XUWVYBQIKCVCEH-KQYNXXCUBA
(4)Std. InChI: InChI=1S/C10H11FN4O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2/t4-,6-,7-,10-/m1/s1
(5)Std. InChIKey: XUWVYBQIKCVCEH-KQYNXXCUSA-N