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6-Chloro-2-iodo-9-(2,3,5-tri-O-acetyl)-beta-D-ribofuranosyl-9H-purine

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Basic information
Standard English name
Cas No. 5987-76-8
Alias (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-chloro-2-iodo-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate
Canonical Smiles CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1N1C=NC2=C(Cl)N=C(I)N=C12
MDL No. MFCD03701153
Exact Mass 537.97522
Smiles O=C(OC[C@@H]1[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](N2C=NC3=C(Cl)N=C(I)N=C23)O1)C
Security information
Character
Storage Condition
Melting Point 181-183°C
Boiling Point 643.3±65.0 °C(Predicted)
Flash Point
Chemical Stability
Density 1.98±0.1 g/cm3(Predicted)
Vapor Pressure
GHS
Signal Word
Dangerous Goods GHS07
Hazard Category H302+H312+H332;H315;H319;H335
Hazard Codes
Prevention Guidelines
Hazard Statements
Safety Instructions P260;P280;P301+P310
Water Solubility
Storage Temp.
Hazardous Decomposition Products
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Physicochemical Propertie
Transport Condition
HS Code
UN No.
Feature Warning
Useage
Inchi InChI=1S/C16H16ClIN4O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(17)20-16(18)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3/t9-,11-,12-,15-/m1/s1
InchiKey BYOJIJDSBSWKKE-SDBHATRESA-N
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