ChemSpider 2D Image | 2-Methyl-2-propanyl 10-{2-[2-(2-propyn-1-yloxy)ethoxy]ethyl}-4,7,13,16-tetraoxa-10-azanonadec-18-yn-1-oate | C25H43NO8

2-Methyl-2-propanyl 10-{2-[2-(2-propyn-1-yloxy)ethoxy]ethyl}-4,7,13,16-tetraoxa-10-azanonadec-18-yn-1-oate

  • Molecular FormulaC25H43NO8
  • Average mass485.611 Da
  • Monoisotopic mass485.298859 Da
  • ChemSpider ID68019893

More details:

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

10-{2-[2-(2-Propyn-1-yloxy)éthoxy]éthyl}-4,7,13,16-tétraoxa-10-azanonadéc-18-yn-1-oate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 10-{2-[2-(2-propyn-1-yloxy)ethoxy]ethyl}-4,7,13,16-tetraoxa-10-azanonadec-18-yn-1-oate [ACD/IUPAC Name]
2-Methyl-2-propanyl-10-{2-[2-(2-propin-1-yloxy)ethoxy]ethyl}-4,7,13,16-tetraoxa-10-azanonadec-18-in-1-oat [German] [ACD/IUPAC Name]
4,7,13,16-Tetraoxa-10-azanonadec-18-yn-1-oic acid, 10-[2-[2-(2-propyn-1-yloxy)ethoxy]ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2100306-69-0 [RN]
MFCD30723248
N-(PEG2-Boc)-N-bis(PEG2-propargyl)
N-(t-butyl ester-PEG2)-N-bis(PEG2-propargyl)
tert-butyl 10-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethyl}-4,7,13,16-tetraoxa-10-azanonadec-18-ynoate
tert-butyl 3-[2-[2-[bis[2-(2-prop-2-ynoxyethoxy)ethyl]amino]ethoxy]ethoxy]propanoate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 531.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±3.0 kJ/mol
Flash Point: 275.1±28.7 °C
Index of Refraction: 1.478
Molar Refractivity: 129.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 27
#Rule of 5 Violations: 0
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.55
ACD/LogD (pH 7.4): 0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.27
Polar Surface Area: 85 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 457.7±3.0 cm3

Click to predict properties on the Chemicalize site


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