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2'-C-Methyl-5'-O-[(phosphonatooxy)phosphinato]adenosine
[CAS# 150993-72-9]

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CAS#: 150993-72-9
Product: 2'-C-Methyl-5'-O-[(phosphonatooxy)phosphinato]adenosine
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Identification
Name 2'-C-Methyl-5'-O-[(phosphonatooxy)phosphinato]adenosine
Synonyms 2'C-methyladenosine 5'-diphosphate
Molecular Structure CAS#: 150993-72-9, 2'-C-Methyl-5'-O-[(phosphonatooxy)phosphinato]adenosine
Molecular Formula C11H14N5O10P2
Molecular Weight 438.21
CAS Registry Number 150993-72-9
SMILES C[C@]1([C@@H]([C@H](O[C@H]1n2cnc3c2ncnc3N)COP(=O)([O-])OP(=O)([O-])[O-])O)O
InChI 1S/C11H17N5O10P2/c1-11(18)7(17)5(2-24-28(22,23)26-27(19,20)21)25-10(11)16-4-15-6-8(12)13-3-14-9(6)16/h3-5,7,10,17-18H,2H2,1H3,(H,22,23)(H2,12,13,14)(H2,19,20,21)/p-3/t5-,7-,10-,11-/m1/s1
InChIKey RYJCYMQAEPHSPQ-YRKGHMEHSA-K
Properties
Density 2.3g/cm3 (Cal.)
Boiling point 847.253°C at 760 mmHg (Cal.)
Flash point 466.202°C (Cal.)
Refractive index 1.839 (Cal.)
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