Found 1 result

Search term: MTVPGFFXVTZGIM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Ethyl (3S,4R)-1,4-dihydroxy-2-oxo-1,2,3,4-tetrahydro-1,8-naphthyridine-3-carboxylate | C11H12N2O5

Ethyl (3S,4R)-1,4-dihydroxy-2-oxo-1,2,3,4-tetrahydro-1,8-naphthyridine-3-carboxylate

  • Molecular FormulaC11H12N2O5
  • Average mass252.223 Da
  • Monoisotopic mass252.075000 Da
  • ChemSpider ID25058893

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S,4R)-1,4-Dihydroxy-2-oxo-1,2,3,4-tétrahydro-1,8-naphtyridine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1,8-Naphthyridine-3-carboxylic acid, 1,2,3,4-tetrahydro-1,4-dihydroxy-2-oxo-, ethyl ester, (3S,4R)- [ACD/Index Name]
Ethyl (3S,4R)-1,4-dihydroxy-2-oxo-1,2,3,4-tetrahydro-1,8-naphthyridine-3-carboxylate [ACD/IUPAC Name]
Ethyl-(3S,4R)-1,4-dihydroxy-2-oxo-1,2,3,4-tetrahydro-1,8-naphthyridin-3-carboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.0 g/cm3
Boiling Point: 449.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 74.7±0.0 kJ/mol
Flash Point: 225.9±0.0 °C
Index of Refraction: 1.633
Molar Refractivity: 59.0±0.0 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.58
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.85
Polar Surface Area: 100 Å2
Polarizability: 23.4±0.0 10-24cm3
Surface Tension: 80.9±0.0 dyne/cm
Molar Volume: 165.1±0.0 cm3

Click to predict properties on the Chemicalize site


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