ChemSpider 2D Image | Methyl 2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-2-propenoyl}amino)-4-(5,6,7,8-tetrahydro-2-naphthalenyl)-3-thiophenecarboxylate | C32H37NO5S

Methyl 2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-2-propenoyl}amino)-4-(5,6,7,8-tetrahydro-2-naphthalenyl)-3-thiophenecarboxylate

  • Molecular FormulaC32H37NO5S
  • Average mass547.705 Da
  • Monoisotopic mass547.239258 Da
  • ChemSpider ID12176017

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({(2E)-3-[4-(Hexyloxy)-3-méthoxyphényl]-2-propenoyl}amino)-4-(5,6,7,8-tétrahydro-2-naphtalényl)-3-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-[[(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-1-oxo-2-propen-1-yl]amino]-4-(5,6,7,8-tetrahydro-2-naphthalenyl)-, methyl ester [ACD/Index Name]
Methyl 2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-2-propenoyl}amino)-4-(5,6,7,8-tetrahydro-2-naphthalenyl)-3-thiophenecarboxylate [ACD/IUPAC Name]
Methyl 2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]prop-2-enoyl}amino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate
Methyl-2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-2-propenoyl}amino)-4-(5,6,7,8-tetrahydro-2-naphthalinyl)-3-thiophencarboxylat [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: 723.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 391.2±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 159.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 10.77
ACD/LogD (pH 5.5): 8.76
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1395594.25
ACD/LogD (pH 7.4): 8.76
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1395563.63
Polar Surface Area: 102 Å2
Polarizability: 63.2±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 461.4±3.0 cm3

Click to predict properties on the Chemicalize site


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