Found 79 results

Search term: MF = 'C_{26}H_{32}O_{10}'
ChemSpider 2D Image | 2-[3-(2,3-Dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-isopropylphenyl beta-D-glucopyranoside | C26H32O10

2-[3-(2,3-Dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-isopropylphenyl β-D-glucopyranoside

  • Molecular FormulaC26H32O10
  • Average mass504.526 Da
  • Monoisotopic mass504.199554 Da
  • ChemSpider ID23250301

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1-Propanone, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2-(β-D-glucopyranosyloxy)-6-hydroxy-4-(1-methylethyl)phenyl]- [ACD/Index Name]
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-(propan-2-yl)phenyl β-D-glucopyranoside
2-[3-(2,3-Dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-isopropylphenyl β-D-glucopyranoside [ACD/IUPAC Name]
2-[3-(2,3-Dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-isopropylphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]-3-hydroxy-5-isopropylphényle [French] [ACD/IUPAC Name]
3-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-1-[2-hydroxy-4-isopropyl-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-phenyl]-propan-1-one
CHEMBL365222

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

Density: 1.4±0.1 g/cm3
Boiling Point: 762.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 255.9±26.4 °C
Index of Refraction: 1.623
Molar Refractivity: 127.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 9.33
ACD/KOC (pH 5.5): 171.59
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 4.78
ACD/KOC (pH 7.4): 87.79
Polar Surface Area: 155 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 362.7±3.0 cm3

Click to predict properties on the Chemicalize site


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