Found 14 results

Search term: MF = 'C_{24}H_{31}ClO_{10}'
ChemSpider 2D Image | 3-Chloro-6a,12-dihydroxy-6,8,11a-trimethyl-2-methylene-5-oxohexadecahydro-10,11-epoxybenzo[4,5]oxireno[7,8]cyclodeca[1,2-b]furan-7,9-diyl diacetate | C24H31ClO10

3-Chloro-6a,12-dihydroxy-6,8,11a-trimethyl-2-methylene-5-oxohexadecahydro-10,11-epoxybenzo[4,5]oxireno[7,8]cyclodeca[1,2-b]furan-7,9-diyl diacetate

  • Molecular FormulaC24H31ClO10
  • Average mass514.950 Da
  • Monoisotopic mass514.160583 Da
  • ChemSpider ID2340455

More details:

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

10,11-Epoxybenz[4,5]oxireno[7,8]cyclodeca[1,2-b]furan-5(2H)-one, 7,9-bis(acetyloxy)-3-chlorotetradecahydro-6a,12-dihydroxy-6,8,11a-trimethyl-2-methylene- [ACD/Index Name]
3-Chlor-6a,12-dihydroxy-6,8,11a-trimethyl-2-methylen-5-oxohexadecahydro-10,11-epoxybenzo[4,5]oxireno[7,8]cyclodeca[1,2-b]furan-7,9-diyl-diacetat [German] [ACD/IUPAC Name]
3-Chloro-6a,12-dihydroxy-6,8,11a-trimethyl-2-methylene-5-oxohexadecahydro-10,11-epoxybenzo[4,5]oxireno[7,8]cyclodeca[1,2-b]furan-7,9-diyl diacetate [ACD/IUPAC Name]
Diacétate de 3-chloro-6a,12-dihydroxy-6,8,11a-triméthyl-2-méthylène-5-oxohexadécahydro-10,11-époxybenzo[4,5]oxiréno[7,8]cyclodéca[1,2-b]furane-7,9-diyle [French] [ACD/IUPAC Name]
131400-39-0 [RN]
brianolide
Oxireno(7,8)oxireno(3',4')benzo(1',2':4,5)cyclodeca(1,2-b)furan-2(3H)-one, 4,6-bis(acetyloxy)-11-chlorotetradecahydro-3a,8-dihydroxy-3,5,7b-trimethyl-10-methylene-, (3R-(3R*,3aR*,4S*,4aS*,5R*,6R*,6aS*,7aR*,7bS*,8R*,8aS*,9aR*,11S*,11aR*))-

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

Density: 1.4±0.1 g/cm3
Boiling Point: 628.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.6±6.0 kJ/mol
Flash Point: 334.1±31.5 °C
Index of Refraction: 1.580
Molar Refractivity: 119.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.85
ACD/LogD (pH 5.5): 0.76
ACD/BCF (pH 5.5): 2.22
ACD/KOC (pH 5.5): 61.55
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 2.22
ACD/KOC (pH 7.4): 61.54
Polar Surface Area: 144 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 57.8±5.0 dyne/cm
Molar Volume: 358.2±5.0 cm3

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