Found 15 results

Search term: MF = 'C_{34}H_{41}NO_{6}S'
ChemSpider 2D Image | Methyl 3-({[(6-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]-5-{[8-(4-methoxyphenyl)octyl]oxy}-2-pyridinyl)methyl]sulfanyl}methyl)benzoate | C34H41NO6S

Methyl 3-({[(6-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]-5-{[8-(4-methoxyphenyl)octyl]oxy}-2-pyridinyl)methyl]sulfanyl}methyl)benzoate

  • Molecular FormulaC34H41NO6S
  • Average mass591.757 Da
  • Monoisotopic mass591.265442 Da
  • ChemSpider ID8658988

  • Double-bond stereo - Double-bond stereo

More details:

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

3-({[(6-[(1E)-3-Méthoxy-3-oxo-1-propén-1-yl]-5-{[8-(4-méthoxyphényl)octyl]oxy}-2-pyridinyl)méthyl]sulfanyl}méthyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[[[6-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]-5-[[8-(4-methoxyphenyl)octyl]oxy]-2-pyridinyl]methyl]thio]methyl]-, methyl ester [ACD/Index Name]
Methyl 3-({[(6-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]-5-{[8-(4-methoxyphenyl)octyl]oxy}-2-pyridinyl)methyl]sulfanyl}methyl)benzoate [ACD/IUPAC Name]
Methyl-3-({[(6-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]-5-{[8-(4-methoxyphenyl)octyl]oxy}-2-pyridinyl)methyl]sulfanyl}methyl)benzoat [German] [ACD/IUPAC 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: 719.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 389.2±32.9 °C
Index of Refraction: 1.580
Molar Refractivity: 170.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 8.23
ACD/LogD (pH 5.5): 7.56
ACD/BCF (pH 5.5): 327056.06
ACD/KOC (pH 5.5): 308078.78
ACD/LogD (pH 7.4): 7.56
ACD/BCF (pH 7.4): 327785.13
ACD/KOC (pH 7.4): 308765.53
Polar Surface Area: 109 Å2
Polarizability: 67.7±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 513.3±3.0 cm3

Click to predict properties on the Chemicalize site


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