ChemSpider 2D Image | Ethyl 16-benzyl-2,2-dimethyl-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-4,15-dioxo-3-oxa-5,7,14-triazaheptadec-6-en-17-oate | C29H46N4O7

Ethyl 16-benzyl-2,2-dimethyl-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-4,15-dioxo-3-oxa-5,7,14-triazaheptadec-6-en-17-oate

  • Molecular FormulaC29H46N4O7
  • Average mass562.698 Da
  • Monoisotopic mass562.336670 Da
  • ChemSpider ID8706349

More details:

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

16-Benzyl-2,2-diméthyl-6-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-4,15-dioxo-3-oxa-5,7,14-triazaheptadéc-6-én-17-oate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-[10-[[(1,1-dimethylethoxy)carbonyl]amino]-14,14-dimethyl-1,12-dioxo-13-oxa-2,9,11-triazapentadec-9-en-1-yl]-, ethyl ester [ACD/Index Name]
Ethyl 16-benzyl-2,2-dimethyl-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-4,15-dioxo-3-oxa-5,7,14-triazaheptadec-6-en-17-oate [ACD/IUPAC Name]
Ethyl-16-benzyl-2,2-dimethyl-6-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-4,15-dioxo-3-oxa-5,7,14-triazaheptadec-6-en-17-oat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.522
Molar Refractivity: 153.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 4446.23
ACD/KOC (pH 5.5): 14215.38
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 4265.80
ACD/KOC (pH 7.4): 13638.53
Polar Surface Area: 144 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 502.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement