ChemSpider 2D Image | Trinexapac-ethyl | C13H16O5

Trinexapac-ethyl

  • Molecular FormulaC13H16O5
  • Average mass252.263 Da
  • Monoisotopic mass252.099777 Da
  • ChemSpider ID26502395

More details:






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

Trinexapac-ethyl [BSI] [ISO]
4-(cyclopropylhydroxymethylene)-3,5-dioxocyclohexanecarboxylic Acid Ethyl Ester;;Ethyl 4-(cyclopropyl(hydroxy)methylene)-3,5-dioxocyclohexanecarboxylate
4-[Cyclopropyl(hydroxy)méthylène]-3,5-dioxocyclohexanecarboxylate d'éthyle [French] [ACD/IUPAC Name]
95266-40-3 [RN]
Cyclohexanecarboxylic acid, 4-(cyclopropylhydroxymethylene)-3,5-dioxo-, ethyl ester [ACD/Index Name]
Ethyl 4-(cyclopropyl(hydroxy)methylene)-3,5-dioxocyclohexanecarboxylate
Ethyl 4-[cyclopropyl(hydroxy)methylene]-3,5-dioxocyclohexanecarboxylate [ACD/IUPAC Name]
Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexanecarboxylate [ACD/IUPAC Name]
ETHYL-4-(CYCLOPROPYL(HYDROXY)METHYLENE)-3,5-DIOXOCYCLOHEXANECARBOXYLATE
Ethyl-4-[cyclopropyl(hydroxy)methylen]-3,5-dioxocyclohexancarboxylat [German] [ACD/IUPAC Name]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 399.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.2±6.0 kJ/mol
Flash Point: 150.8±21.4 °C
Index of Refraction: 1.572
Molar Refractivity: 61.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.02
ACD/LogD (pH 7.4): -2.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 185.7±3.0 cm3

Click to predict properties on the Chemicalize site






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