ChemSpider 2D Image | (9E)-3-Hydroxy-1,9-pentadecadiene-4,6-diyn-8-yl acetate | C17H22O3

(9E)-3-Hydroxy-1,9-pentadecadiene-4,6-diyn-8-yl acetate

  • Molecular FormulaC17H22O3
  • Average mass274.355 Da
  • Monoisotopic mass274.156891 Da
  • ChemSpider ID30647255

  • Double-bond stereo - Double-bond stereo

More details:

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

(9E)-3-Hydroxy-1,9-pentadecadien-4,6-diin-8-yl-acetat [German] [ACD/IUPAC Name]
(9E)-3-Hydroxy-1,9-pentadecadiene-4,6-diyn-8-yl acetate [ACD/IUPAC Name]
1,9-Pentadecadiene-4,6-diyne-3,8-diol, 8-acetate, (9E)- [ACD/Index Name]
Acétate de (9E)-3-hydroxy-1,9-pentadécadiène-4,6-diyn-8-yle [French] [ACD/IUPAC Name]
[41682-30-8] [RN]
3-Hydroxypentadeca-1,9-dien-4,6-diyn-8-yl acetate
41682-30-8 [RN]
8-acetoxy-1,9(Z)-pentadecadien-4,6-diyn-3-ol
8-Acetoxypentadeca-1,9Z-diene-4,6-diyn-3-ol
MFCD23703026

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

Density: 1.0±0.1 g/cm3
Boiling Point: 412.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.8±6.0 kJ/mol
Flash Point: 164.8±21.5 °C
Index of Refraction: 1.512
Molar Refractivity: 79.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5620.22
ACD/KOC (pH 5.5): 16813.79
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5620.05
ACD/KOC (pH 7.4): 16813.27
Polar Surface Area: 47 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 266.2±3.0 cm3

Click to predict properties on the Chemicalize site


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