Found 26 results

Search term: MF = 'C_{43}H_{74}O_{2}'
ChemSpider 2D Image | (3beta,5xi,9xi,14xi,18xi,20xi)-5-Methylurs-12-en-3-yl laurate | C43H74O2

(3β,5ξ,9ξ,14ξ,18ξ,20ξ)-5-Methylurs-12-en-3-yl laurate

  • Molecular FormulaC43H74O2
  • Average mass623.047 Da
  • Monoisotopic mass622.568909 Da
  • ChemSpider ID4476916

  • defined stereocentres - 5 of 10 defined stereocentres

More details:

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

(3β,5ξ,9ξ,14ξ,18ξ,20ξ)-5-Methylurs-12-en-3-yl laurate [ACD/IUPAC Name]
(3β,5ξ,9ξ,14ξ,18ξ,20ξ)-5-Methylurs-12-en-3-yllaurat [German] [ACD/IUPAC Name]
Dodecanoic acid, (3β,5ξ,9ξ,14ξ,18ξ,20ξ)-5-methylurs-12-en-3-yl ester [ACD/Index Name]
Laurate de (3β,5ξ,9ξ,14ξ,18ξ,20ξ)-5-méthylurs-12-én-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 626.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 331.9±19.0 °C
Index of Refraction: 1.517
Molar Refractivity: 192.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 17.69
ACD/LogD (pH 5.5): 16.68
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.68
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 76.3±0.5 10-24cm3
Surface Tension: 38.4±5.0 dyne/cm
Molar Volume: 635.8±5.0 cm3

Click to predict properties on the Chemicalize site


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