ChemSpider 2D Image | MFCD09836212 | C14H22O4

MFCD09836212

  • Molecular FormulaC14H22O4
  • Average mass254.322 Da
  • Monoisotopic mass254.151810 Da
  • ChemSpider ID21884673

More details:






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

7-Nonynoic acid, 9-[(tetrahydro-2H-pyran-2-yl)oxy]- [ACD/Index Name]
9-(Tetrahydro-2H-pyran-2-yloxy)-7-noninsäure [German] [ACD/IUPAC Name]
9-(Tetrahydro-2H-pyran-2-yloxy)-7-nonynoic acid [ACD/IUPAC Name]
957761-18-1 [RN]
Acide 9-(tétrahydro-2H-pyran-2-yloxy)-7-nonynoïque [French] [ACD/IUPAC Name]
MFCD09836212
9-(OXAN-2-YLOXY)NON-7-YNOIC ACID
9-(Tetrahydro-2H-pyran-2-yloxy)-7-nonynoicacid
9-[(Oxan-2-yl)oxy]non-7-ynoic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 429.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±6.0 kJ/mol
Flash Point: 158.2±22.2 °C
Index of Refraction: 1.498
Molar Refractivity: 68.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 2.88
ACD/KOC (pH 5.5): 43.12
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 44.7±5.0 dyne/cm
Molar Volume: 231.8±5.0 cm3

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