ChemSpider 2D Image | 15-[(Carboxymethyl)amino]retinal | C22H31NO3

15-[(Carboxymethyl)amino]retinal

  • Molecular FormulaC22H31NO3
  • Average mass357.486 Da
  • Monoisotopic mass357.230408 Da
  • ChemSpider ID115296536

  • Double-bond stereo - Double-bond stereo

More details:

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

15-[(Carboxymethyl)amino]retinal [ACD/IUPAC Name]
15-[(Carboxymethyl)amino]retinal [German] [ACD/IUPAC Name]
15-[(Carboxyméthyl)amino]rétinal [French] [ACD/IUPAC Name]
Retinal, 15-[(carboxymethyl)amino]- [ACD/Index 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: 580.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 94.9±6.0 kJ/mol
Flash Point: 305.0±27.9 °C
Index of Refraction: 1.558
Molar Refractivity: 108.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 13.92
ACD/KOC (pH 5.5): 54.25
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.20
Polar Surface Area: 66 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 336.1±3.0 cm3

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