ChemSpider 2D Image | {2-[(1E)-1-Penten-1-yl]-1,3-dioxolan-4-yl}methanol | C9H16O3

{2-[(1E)-1-Penten-1-yl]-1,3-dioxolan-4-yl}methanol

  • Molecular FormulaC9H16O3
  • Average mass172.221 Da
  • Monoisotopic mass172.109940 Da
  • ChemSpider ID32699444

  • Double-bond stereo - Double-bond stereo

More details:

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

{2-[(1E)-1-Penten-1-yl]-1,3-dioxolan-4-yl}methanol [ACD/IUPAC Name]
{2-[(1E)-1-Penten-1-yl]-1,3-dioxolan-4-yl}methanol [German] [ACD/IUPAC Name]
{2-[(1E)-1-Pentén-1-yl]-1,3-dioxolan-4-yl}méthanol [French] [ACD/IUPAC Name]
1,3-Dioxolane-4-methanol, 2-[(1E)-1-penten-1-yl]- [ACD/Index Name]
2-[(1E)-1-Penten-1-yl]-1,3-dioxolane-4-methanol
214220-85-6 [RN]
T5O COTJ B1U4 D1Q &&E Form [WLN]
(E)-Pentenyl-1,3-dioxolane-4-methanol

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

E26V0RZO1W [DBID]
UNII:E26V0RZO1W [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 244.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 56.0±6.0 kJ/mol
Flash Point: 117.3±6.9 °C
Index of Refraction: 1.522
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 6.07
ACD/KOC (pH 5.5): 126.56
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 6.07
ACD/KOC (pH 7.4): 126.56
Polar Surface Area: 39 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 158.3±3.0 cm3

Click to predict properties on the Chemicalize site


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