ChemSpider 2D Image | N-{[(4-Ethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}glycylglycylglycine | C19H21N3O8

N-{[(4-Ethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}glycylglycylglycine

  • Molecular FormulaC19H21N3O8
  • Average mass419.385 Da
  • Monoisotopic mass419.132874 Da
  • ChemSpider ID21750052

More details:

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

Glycine, N-[2-[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl]glycylglycyl- [ACD/Index Name]
N-{[(4-Ethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}glycylglycylglycin [German] [ACD/IUPAC Name]
N-{[(4-Ethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}glycylglycylglycine [ACD/IUPAC Name]
N-{2-[(4-Éthyl-2-oxo-2H-chromén-7-yl)oxy]acétyl}glycylglycylglycine [French] [ACD/IUPAC Name]
(2-{2-[2-(4-Ethyl-2-oxo-2H-chromen-7-yloxy)-acetylamino]-acetylamino}-acetylamino)-acetic acid
2-(2-(2-(2-((4-ethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)acetamido)acetic acid
2-(2-{2-[2-(4-ethyl-2-oxochromen-7-yloxy)acetylamino]acetylamino}acetylamino)acetic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 911.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.9±3.0 kJ/mol
Flash Point: 505.2±34.3 °C
Index of Refraction: 1.575
Molar Refractivity: 100.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -2.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 58.8±3.0 dyne/cm
Molar Volume: 304.6±3.0 cm3

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