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Search term: MF = 'C_{28}H_{33}N_{3}O_{5}'
ChemSpider 2D Image | 2-Methyl-2-propanyl [2-(2-{[4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanoyl]amino}ethoxy)ethyl]carbamate | C28H33N3O5

2-Methyl-2-propanyl [2-(2-{[4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanoyl]amino}ethoxy)ethyl]carbamate

  • Molecular FormulaC28H33N3O5
  • Average mass491.579 Da
  • Monoisotopic mass491.242035 Da
  • ChemSpider ID78434545

More details:

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

[2-(2-{[4-(11,12-Didéhydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanoyl]amino}éthoxy)éthyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [2-(2-{[4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanoyl]amino}ethoxy)ethyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[2-(2-{[4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanoyl]amino}ethoxy)ethyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[2-[[4-(11,12-didehydrodibenz[b,f]azocin-5(6H)-yl)-1,4-dioxobutyl]amino]ethoxy]ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2364591-77-3 [RN]
DBCO-PEG1-NH-Boc
tert-butyl N-[2-[2-[[4-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4-oxobutanoyl]amino]ethoxy]ethyl]carbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 778.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.3±3.0 kJ/mol
Flash Point: 424.5±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 136.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 4.07
ACD/BCF (pH 5.5): 735.73
ACD/KOC (pH 5.5): 3922.82
ACD/LogD (pH 7.4): 4.07
ACD/BCF (pH 7.4): 735.72
ACD/KOC (pH 7.4): 3922.77
Polar Surface Area: 97 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 398.4±5.0 cm3

Click to predict properties on the Chemicalize site


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