Found 1 result

Search term: (2R)-4,7-dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside (Found by approved synonym)

ChemSpider 2D Image | TRIBOA beta-D-glucoside | C14H17NO10

TRIBOA β-D-glucoside

  • Molecular FormulaC14H17NO10
  • Average mass359.285 Da
  • Monoisotopic mass359.085236 Da
  • ChemSpider ID26606379
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

(2R)-4,7-Dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl β-D-glucopyranoside [ACD/IUPAC Name]
(2R)-4,7-Dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2H-1,4-Benzoxazin-3(4H)-one, 2-(β-D-glucopyranosyloxy)-4,7-dihydroxy-, (2R)- [ACD/Index Name]
TRIBOA β-D-glucoside
β-D-Glucopyranoside de (2R)-4,7-dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yle [French] [ACD/IUPAC Name]
(R)-TRIBOA β-D-glucoside

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

CHEBI:63671 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 731.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.0±3.0 kJ/mol
Flash Point: 396.0±35.7 °C
Index of Refraction: 1.742
Molar Refractivity: 78.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -3.62
ACD/LogD (pH 5.5): -2.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 123.8±5.0 dyne/cm
Molar Volume: 193.1±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement