Found 241 results

Search term: MF = 'C_{13}H_{19}N_{3}O_{6}'
ChemSpider 2D Image | 1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-({[1-(2-hydroxyethyl)-1H-pyrazol-5-yl]carbonyl}amino)-D-threo-pentitol | C13H19N3O6

1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-({[1-(2-hydroxyethyl)-1H-pyrazol-5-yl]carbonyl}amino)-D-threo-pentitol

  • Molecular FormulaC13H19N3O6
  • Average mass313.306 Da
  • Monoisotopic mass313.127380 Da
  • ChemSpider ID35047900

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-({[1-(2-hydroxyethyl)-1H-pyrazol-5-yl]carbonyl}amino)-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxymethyl)-3,4-didesoxy-3-({[1-(2-hydroxyethyl)-1H-pyrazol-5-yl]carbonyl}amino)-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxyméthyl)-3,4-didésoxy-3-({[1-(2-hydroxyéthyl)-1H-pyrazol-5-yl]carbonyl}amino)-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-[[[1-(2-hydroxyethyl)-1H-pyrazol-5-yl]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 689.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 370.5±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 73.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.74
ACD/LogD (pH 5.5): -3.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 61.9±7.0 dyne/cm
Molar Volume: 207.2±7.0 cm3

Click to predict properties on the Chemicalize site


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