CAS 163706-58-9|(2R,3S,4R,5R)-2-(hydroxyMethyl)-5-(6-((2-(Methylthio)ethyl)aMino)-2-((3,3,3-t

Introduction:Basic information about CAS 163706-58-9|(2R,3S,4R,5R)-2-(hydroxyMethyl)-5-(6-((2-(Methylthio)ethyl)aMino)-2-((3,3,3-t, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name(2R,3S,4R,5R)-2-(hydroxyMethyl)-5-(6-((2-(Methylthio)ethyl)aMino)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
CAS Number163706-58-9Molecular Weight469.502
Density1.7±0.1 g/cm3Boiling Point747.5±70.0 °C at 760 mmHg
Molecular FormulaC16H22F3N5O4S2Melting Point/
MSDS/Flash Point405.9±35.7 °C

Names

NameN6-(2-methylthioethyl)-2-(3,3,3-trifluoropropylthio)adenosine
SynonymMore Synonyms

Chemical & Physical Properties

Density1.7±0.1 g/cm3
Boiling Point747.5±70.0 °C at 760 mmHg
Molecular FormulaC16H22F3N5O4S2
Molecular Weight469.502
Flash Point405.9±35.7 °C
Exact Mass469.106537
PSA176.15000
LogP2.07
Vapour Pressure0.0±2.6 mmHg at 25°C
Index of Refraction1.685
InChIKeyZGVUPMJCZYBIDI-IDTAVKCVSA-N
SMILESCSCCNc1nc(SCCC(F)(F)F)nc2c1ncn2C1OC(CO)C(O)C1O

Synonyms

Cangrelor Intermediate
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-((2-(methylthio)ethyl)amino)-2-((3,3,3-trifluoropropyl)thio)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
Adenosine, N-[2-(methylthio)ethyl]-2-[(3,3,3-trifluoropropyl)thio]-
N-[2-(Methylsulfanyl)ethyl]-2-[(3,3,3-trifluoropropyl)sulfanyl]adenosine
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