ChemSpider 2D Image | Ethyl 3-[3-(2-ethoxy-2-oxoethyl)-1-methyl-1H-indol-2-yl]propanoate | C18H23NO4

Ethyl 3-[3-(2-ethoxy-2-oxoethyl)-1-methyl-1H-indol-2-yl]propanoate

  • Molecular FormulaC18H23NO4
  • Average mass317.379 Da
  • Monoisotopic mass317.162720 Da
  • ChemSpider ID24598872

More details:






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

[74120-22-2]
74120-22-2 [RN]
'74120-22-2
Ethyl 3-(3-(2-ethoxy-2-oxoethyl)-1-methyl-1H-indol-2-yl)propanoate
Ethyl 3-[3-(2-ethoxy-2-oxoethyl)-1-methyl-1H-indol-2-yl]propanoate [ACD/IUPAC Name]
ETHYL 3-[3-(2-ETHOXY-2-OXOETHYL)-1-METHYLINDOL-2-YL]PROPANOATE
ETHYL-3-(3-(2-ETHOXY-2-OXOETHYL)-1-METHYL-1H-INDOL-2-YL)PROPANOATE
MFCD15071422 [MDL number]

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-15121]
    • Safety:

      20/21/22 Novochemy [NC-15121]
      20/21/36/37/39 Novochemy [NC-15121]
      GHS07; GHS09 Novochemy [NC-15121]
      H332; H403 Novochemy [NC-15121]
      P301+P310; P337+P313 Novochemy [NC-15121]
      Warning Novochemy [NC-15121]
      Xn Novochemy [NC-15121]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 444.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.5±25.9 °C
Index of Refraction: 1.541
Molar Refractivity: 88.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 220.40
ACD/KOC (pH 5.5): 1655.29
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 220.40
ACD/KOC (pH 7.4): 1655.29
Polar Surface Area: 58 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 38.7±7.0 dyne/cm
Molar Volume: 281.1±7.0 cm3

Click to predict properties on the Chemicalize site






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