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61135-33-9,MFCD01675687
Catalog No.:AA00IAQJ

61135-33-9 | 5-Ethynyl-2'-deoxyuridine

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100mg
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250mg
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1g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IAQJ
Chemical Name:
5-Ethynyl-2'-deoxyuridine
CAS Number:
61135-33-9
Molecular Formula:
C11H12N2O5
Molecular Weight:
252.2234
MDL Number:
MFCD01675687
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#C)c(=O)[nH]c1=O
Properties
Computed Properties
 
Complexity:
463  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
-1.3  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1986,vol.51,p.950-951

[1]JournalofOrganicChemistry,1986,vol.51,p.950-951

[1]TetrahedronLetters,1981,vol.22,p.421-424

[2]JournalofOrganicChemistry,1983,vol.48,p.1854-1862

[3]JournalofMedicinalChemistry,2005,vol.48,p.7012-7017

[4]JournalofOrganometallicChemistry,2007,vol.692,p.1340-1347

[1]JournaloftheChemicalSociety.PerkintransactionsI,1981,p.1665-1670

(2R,3S,5R)-3-Acetoxy-5-(5-ethynyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethoxy-hydroxy-phosphoryl}-aceticacidethylester 
  117627-05-1    61135-33-9 

[1]JournalofMedicinalChemistry,1989,vol.32,p.367-374

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