ChemSpider 2D Image | N-[6-({[4-(Hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetyl}amino)hexanoyl]-beta-alanine | C14H23N5O5

N-[6-({[4-(Hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetyl}amino)hexanoyl]-β-alanine

  • Molecular FormulaC14H23N5O5
  • Average mass341.363 Da
  • Monoisotopic mass341.169922 Da
  • ChemSpider ID81152937

More details:

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

N-[6-({[4-(Hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetyl}amino)hexanoyl]-β-alanin [German] [ACD/IUPAC Name]
N-[6-({[4-(Hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetyl}amino)hexanoyl]-β-alanine [ACD/IUPAC Name]
N-[6-({2-[4-(Hydroxyméthyl)-1H-1,2,3-triazol-1-yl]acétyl}amino)hexanoyl]-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-[6-[[2-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetyl]amino]-1-oxohexyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.608
Molar Refractivity: 85.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: -3.10
ACD/LogD (pH 5.5): -3.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 59.4±7.0 dyne/cm
Molar Volume: 245.5±7.0 cm3

Click to predict properties on the Chemicalize site


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