ChemSpider 2D Image | 2-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-yl 8-aminooctanoate | C32H40N2O6S

2-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-yl 8-aminooctanoate

  • Molecular FormulaC32H40N2O6S
  • Average mass580.735 Da
  • Monoisotopic mass580.260681 Da
  • ChemSpider ID28497253

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-yliden)methyl]phenoxy}methyl)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-yl-8-aminooctanoat [German] [ACD/IUPAC Name]
2-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-yl 8-aminooctanoate [ACD/IUPAC Name]
8-Aminooctanoate de 2-({4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidène)méthyl]phénoxy}méthyl)-2,5,7,8-tétraméthyl-3,4-dihydro-2H-chromén-6-yle [French] [ACD/IUPAC Name]
Octanoic acid, 8-amino-, 2-[[4-[(Z)-(2,4-dioxo-5-thiazolidinylidene)methyl]phenoxy]methyl]-3,4-dihydro-2,5,7,8-tetramethyl-2H-1-benzopyran-6-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.593
Molar Refractivity: 162.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.21
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 6.29
ACD/KOC (pH 5.5): 17.22
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 15.75
ACD/KOC (pH 7.4): 43.12
Polar Surface Area: 142 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 479.9±3.0 cm3

Click to predict properties on the Chemicalize site


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