Found 56 results

Search term: MF = 'C_{31}H_{34}O_{8}'
ChemSpider 2D Image | Sarothralin | C31H34O8

Sarothralin

  • Molecular FormulaC31H34O8
  • Average mass534.597 Da
  • Monoisotopic mass534.225342 Da
  • ChemSpider ID30791167

More details:

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

2,5-Cyclohexadien-1-one, 2-[[3-benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]phenyl]methyl]-3,5-dihydroxy-4,4-dimethyl-6-(2-methyl-1-oxopropyl)- [ACD/Index Name]
2-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-6-isobutyryl-4,4-dimethyl-2,5-cyclohexadien-1-on [German] [ACD/IUPAC Name]
2-{3-Benzoyl-2,6-dihydroxy-4-[(3-methyl-2-buten-1-yl)oxy]benzyl}-3,5-dihydroxy-6-isobutyryl-4,4-dimethyl-2,5-cyclohexadien-1-one [ACD/IUPAC Name]
2-{3-Benzoyl-2,6-dihydroxy-4-[(3-méthyl-2-butén-1-yl)oxy]benzyl}-3,5-dihydroxy-6-isobutyryl-4,4-diméthyl-2,5-cyclohexadién-1-one [French] [ACD/IUPAC Name]
Sarothralin
96624-40-7 [RN]

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

C09969 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 758.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 245.6±26.4 °C
Index of Refraction: 1.619
Molar Refractivity: 145.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.16
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 269.85
ACD/KOC (pH 5.5): 796.14
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 1.09
ACD/KOC (pH 7.4): 3.21
Polar Surface Area: 141 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 415.3±3.0 cm3

Click to predict properties on the Chemicalize site


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