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Adenosine-5'-(N-(2-hydroxyethyl))carboxamide

  • Name Adenosine-5'-(N-(2-hydroxyethyl))carboxamide
  • EINECSN/A
  • CAS No. 35788-28-4
  • Density1.99g/cm3
  • PSA168.64000
  • LogP-1.89170
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC12H16N6O5
  • Boiling Point462.64°C (rough estimate)
  • Molecular Weight324.34
  • Flash PointN/A
  • Transport InformationN/A
  • AppearanceN/A
  • SafetyPoison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 35788-28-4 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxy-N-(2-hydroxyethyl)tetrahydrofuran-2-carboxamide (non-preferred name))
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data3

Adenosine-5'-(N-(2-hydroxyethyl))carboxamide Chemical Properties

The Molecular Structure of Adenosine-5'-(N-(2-hydroxyethyl))carboxamide (CAS NO.35788-28-4):
Molecular Formula: C12H16N6O5
Molecular Weight: 324.292640 g/mol
Classification: Drug / Therapeutic Agent 
Density: 1.99 g/cm3 
IUPAC: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-(2-hydroxyethyl)oxolane-2-carboxamide
Nominal Mass: 324 Da
Average Mass: 324.2926 Da
Monoisotopic Mass: 324.118218 Da 
ACD/LogP: -1.59 
Polar Surface Area: 104.07Å2
Index of Refraction: 1.859
Molar Refractivity: 73.08 cm3
Molar Volume: 162.3 cm3
Surface Tension: 101.6 dyne/cm
Smiles: O=C([C@H]1O[C@@H](n2cnc3c2ncnc3N)[C@@H]([C@@H]1O)O)NCCO

Adenosine-5'-(N-(2-hydroxyethyl))carboxamide Toxicity Data With Reference

1.    

orl-mus LD50:5 mg/kg

    JMCMAR    Journal of Medicinal Chemistry. 23 (1980),313.
2.    

ipr-mus LD50:2 mg/kg

    JMCMAR    Journal of Medicinal Chemistry. 23 (1980),313.

Adenosine-5'-(N-(2-hydroxyethyl))carboxamide Safety Profile

Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.

Adenosine-5'-(N-(2-hydroxyethyl))carboxamide Specification

 Adenosine-5'-(N-(2-hydroxyethyl))carboxamide (CAS NO.35788-28-4) is also called as 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2-
hydroxyethyl)ribofuranuronamide ; BRN 0631319 ; Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-1-deoxy-N-(2-hydroxyethyl)- .

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