Found 391 results

Search term: MF = 'C_{13}H_{20}N_{4}O_{5}'
ChemSpider 2D Image | 1,5-Anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-{[4-(1H-1,2,4-triazol-1-yl)butanoyl]amino}-D-threo-pentitol | C13H20N4O5

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

  • Molecular FormulaC13H20N4O5
  • Average mass312.322 Da
  • Monoisotopic mass312.143372 Da
  • ChemSpider ID35057409

  • 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-{[4-(1H-1,2,4-triazol-1-yl)butanoyl]amino}-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxymethyl)-3,4-didesoxy-3-{[4-(1H-1,2,4-triazol-1-yl)butanoyl]amino}-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2-O-(carboxyméthyl)-3,4-didésoxy-3-{[4-(1H-1,2,4-triazol-1-yl)butanoyl]amino}-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2-O-(carboxymethyl)-3,4-dideoxy-3-[[1-oxo-4-(1H-1,2,4-triazol-1-yl)butyl]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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 75.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -2.33
ACD/LogD (pH 5.5): -3.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 116 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 59.2±7.0 dyne/cm
Molar Volume: 214.7±7.0 cm3

Click to predict properties on the Chemicalize site


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