ChemSpider 2D Image | 1-[3-(Carbamoylamino)-3-oxopropyl]-5-[2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-1H-1,2,3-triazole-4-carboxylic acid | C14H22N6O6

1-[3-(Carbamoylamino)-3-oxopropyl]-5-[2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC14H22N6O6
  • Average mass370.361 Da
  • Monoisotopic mass370.160095 Da
  • ChemSpider ID47848475

More details:

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

1-[3-(Carbamoylamino)-3-oxopropyl]-5-[2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-[3-(Carbamoylamino)-3-oxopropyl]-5-[2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-[3-[(aminocarbonyl)amino]-3-oxopropyl]-5-[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethyl]- [ACD/Index Name]
Acide 1-[3-(carbamoylamino)-3-oxopropyl]-5-[2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)éthyl]-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC 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: 1.619
Molar Refractivity: 88.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.47
ACD/LogD (pH 5.5): -1.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 179 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 60.1±7.0 dyne/cm
Molar Volume: 251.5±7.0 cm3

Click to predict properties on the Chemicalize site


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