ChemSpider 2D Image | (2Z)-4-(alpha-L-Altropyranosyloxy)-2-(hydroxymethyl)-2-butenenitrile | C11H17NO7

(2Z)-4-(α-L-Altropyranosyloxy)-2-(hydroxymethyl)-2-butenenitrile

  • Molecular FormulaC11H17NO7
  • Average mass275.255 Da
  • Monoisotopic mass275.100494 Da
  • ChemSpider ID113610887

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2Z)-4-(α-L-Altropyranosyloxy)-2-(hydroxymethyl)-2-butenenitrile [ACD/IUPAC Name]
(2Z)-4-(α-L-Altropyranosyloxy)-2-(hydroxyméthyl)-2-butènenitrile [French] [ACD/IUPAC Name]
(2Z)-4-(α-L-Altropyranosyloxy)-2-(hydroxymethyl)-2-butennitril [German] [ACD/IUPAC Name]
2-Butenenitrile, 4-(α-L-altropyranosyloxy)-2-(hydroxymethyl)-, (2Z)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 621.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.6±6.0 kJ/mol
Flash Point: 329.9±31.5 °C
Index of Refraction: 1.593
Molar Refractivity: 61.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.43
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.56
ACD/LogD (pH 7.4): -2.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.56
Polar Surface Area: 143 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 83.9±5.0 dyne/cm
Molar Volume: 181.7±5.0 cm3

Click to predict properties on the Chemicalize site


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