Found 24 results

Search term: MF = 'C_{34}H_{46}O_{15}'
ChemSpider 2D Image | 6-O-[2-Hydroxy-5-(2-methyl-2-propanyl)benzoyl]-alpha-D-glucopyranosyl 6-O-[2-hydroxy-5-(2-methyl-2-propanyl)benzoyl]-alpha-D-glucopyranoside | C34H46O15

6-O-[2-Hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranosyl 6-O-[2-hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranoside

  • Molecular FormulaC34H46O15
  • Average mass694.720 Da
  • Monoisotopic mass694.283691 Da
  • ChemSpider ID129188271

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

6-O-[2-Hydroxy-5-(2-méthyl-2-propanyl)benzoyl]-α-D-glucopyranoside de 6-O-[2-hydroxy-5-(2-méthyl-2-propanyl)benzoyl]-α-D-glucopyranosyle [French] [ACD/IUPAC Name]
6-O-[2-Hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranosyl 6-O-[2-hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranoside [ACD/IUPAC Name]
6-O-[2-Hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranosyl-6-O-[2-hydroxy-5-(2-methyl-2-propanyl)benzoyl]-α-D-glucopyranosid [German] [ACD/IUPAC Name]
α-D-Glucopyranoside, 6-O-[5-(1,1-dimethylethyl)-2-hydroxybenzoyl]-α-D-glucopyranosyl, 6-[5-(1,1-dimethylethyl)-2-hydroxybenzoate] [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4467631/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 842.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 128.2±3.0 kJ/mol
Flash Point: 259.9±27.8 °C
Index of Refraction: 1.635
Molar Refractivity: 170.2±0.4 cm3
#H bond acceptors: 15
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 4
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 2686.39
ACD/KOC (pH 5.5): 9899.67
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 1922.47
ACD/KOC (pH 7.4): 7084.56
Polar Surface Area: 242 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 77.9±5.0 dyne/cm
Molar Volume: 475.7±5.0 cm3

Click to predict properties on the Chemicalize site


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