ChemSpider 2D Image | 25-Hydroxy-4-(methoxymethyl)-3,8,12,18,20,22-hexamethyl-23,27-dioxo-26-oxapentacyclo[22.2.1.0~1,6~.0~13,22~.0~16,21~]heptacosa-4,7,11,14,24-pentaene-9,17-diyl diacetate | C38H50O9

25-Hydroxy-4-(methoxymethyl)-3,8,12,18,20,22-hexamethyl-23,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,24-pentaene-9,17-diyl diacetate

  • Molecular FormulaC38H50O9
  • Average mass650.798 Da
  • Monoisotopic mass650.345459 Da
  • ChemSpider ID4417274

More details:

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

16a,19-Methano-16aH-benzo[b]naphth[2,1-j]oxacyclotetradecin-20,21(1H)-dione, 4,10-bis(acetyloxy)-2,3,4,4a,6a,9,10,12a,15,16,20a,20b-dodecahydro-18-hydroxy-14-(methoxymethyl)-1,3,7,11,15,20a-hexamethyl - [ACD/Index Name]
25-Hydroxy-4-(methoxymethyl)-3,8,12,18,20,22-hexamethyl-23,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,24-pentaen-9,17-diyl-diacetat [German] [ACD/IUPAC Name]
25-Hydroxy-4-(methoxymethyl)-3,8,12,18,20,22-hexamethyl-23,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,24-pentaene-9,17-diyl diacetate [ACD/IUPAC Name]
Diacétate de 25-hydroxy-4-(méthoxyméthyl)-3,8,12,18,20,22-hexaméthyl-23,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,24-pentaène-9,17-diyle [French] [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: 707.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.2±6.0 kJ/mol
Flash Point: 210.4±26.4 °C
Index of Refraction: 1.569
Molar Refractivity: 175.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 4.75
ACD/BCF (pH 5.5): 1351.50
ACD/KOC (pH 5.5): 3069.38
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 23.31
ACD/KOC (pH 7.4): 52.95
Polar Surface Area: 125 Å2
Polarizability: 69.4±0.5 10-24cm3
Surface Tension: 49.6±5.0 dyne/cm
Molar Volume: 534.3±5.0 cm3

Click to predict properties on the Chemicalize site


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