Found 28 results

Search term: MF = 'C_{39}H_{52}O_{7}'
ChemSpider 2D Image | (3',3',6a',8',10b'-Pentamethyl-5-{2-[(2-methylbenzoyl)oxy]ethyl}dodecahydro-3H-spiro[furan-2,7'-naphtho[2,1-d][1,3]dioxin]-5-yl)methyl 2-methylbenzoate | C39H52O7

(3',3',6a',8',10b'-Pentamethyl-5-{2-[(2-methylbenzoyl)oxy]ethyl}dodecahydro-3H-spiro[furan-2,7'-naphtho[2,1-d][1,3]dioxin]-5-yl)methyl 2-methylbenzoate

  • Molecular FormulaC39H52O7
  • Average mass632.826 Da
  • Monoisotopic mass632.371277 Da
  • ChemSpider ID3016170

More details:

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

(3',3',6a',8',10b'-Pentamethyl-5-{2-[(2-methylbenzoyl)oxy]ethyl}dodecahydro-3H-spiro[furan-2,7'-naphtho[2,1-d][1,3]dioxin]-5-yl)methyl 2-methylbenzoate [ACD/IUPAC Name]
Benzoic acid, 2-methyl-, [dodecahydro-3',3',6'a,8',10'b-pentamethyl-5-[2-[(2-methylbenzoyl)oxy]ethyl]spiro[furan-2(3H),7'-[7H]naphtho[2,1-d][1,3]dioxin]-5-yl]methyl ester [ACD/Index 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: 675.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 274.2±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 177.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 9.40
ACD/LogD (pH 5.5): 8.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1849149.63
ACD/LogD (pH 7.4): 8.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1849149.63
Polar Surface Area: 80 Å2
Polarizability: 70.3±0.5 10-24cm3
Surface Tension: 49.0±5.0 dyne/cm
Molar Volume: 538.8±5.0 cm3

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