Found 42 results

Search term: MF = 'C_{38}H_{60}O_{8}'
ChemSpider 2D Image | (3alpha,12beta,24R)-12-Acetoxy-25-hydroxy-20,24-epoxydammaran-3-yl allyl malonate | C38H60O8

(3α,12β,24R)-12-Acetoxy-25-hydroxy-20,24-epoxydammaran-3-yl allyl malonate

  • Molecular FormulaC38H60O8
  • Average mass644.878 Da
  • Monoisotopic mass644.428833 Da
  • ChemSpider ID24676618

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(3α,12β,24R)-12-Acetoxy-25-hydroxy-20,24-epoxydammaran-3-yl allyl malonate [ACD/IUPAC Name]
(3α,12β,24R)-12-Acetoxy-25-hydroxy-20,24-epoxydammaran-3-yl-allyl-malonat [German] [ACD/IUPAC Name]
Malonate de (3α,12β,24R)-12-acétoxy-25-hydroxy-20,24-époxydammaran-3-yle et d'allyle [French] [ACD/IUPAC Name]
Propanedioic acid, (3α,12β,24R)-12-(acetyloxy)-20,24-epoxy-25-hydroxydammaran-3-yl 2-propen-1-yl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 650.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.8±6.0 kJ/mol
Flash Point: 186.6±25.0 °C
Index of Refraction: 1.534
Molar Refractivity: 176.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.17
ACD/LogD (pH 5.5): 7.88
ACD/BCF (pH 5.5): 576414.06
ACD/KOC (pH 5.5): 462492.19
ACD/LogD (pH 7.4): 7.88
ACD/BCF (pH 7.4): 576363.44
ACD/KOC (pH 7.4): 462451.56
Polar Surface Area: 108 Å2
Polarizability: 69.9±0.5 10-24cm3
Surface Tension: 45.3±5.0 dyne/cm
Molar Volume: 567.3±5.0 cm3

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