ChemSpider 2D Image | MFCD11044866 | C9H20OS

MFCD11044866

  • Molecular FormulaC9H20OS
  • Average mass176.320 Da
  • Monoisotopic mass176.123489 Da
  • ChemSpider ID22439662

More details:

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

131215-92-4 [RN]
1-Nonanol, 9-mercapto- [ACD/Index Name]
9-Mercapto-1-nonanol
9-Mercapto-nonan-1-ol
9-Sulfanyl-1-nonanol [ACD/IUPAC Name]
9-Sulfanyl-1-nonanol [German] [ACD/IUPAC Name]
9-Sulfanyl-1-nonanol [French] [ACD/IUPAC Name]
MFCD11044866
9-mercaptononanol
9-SULFANYLNONAN-1-OL

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

Density: 0.9±0.1 g/cm3
Boiling Point: 269.6±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 59.0±6.0 kJ/mol
Flash Point: 116.8±19.8 °C
Index of Refraction: 1.476
Molar Refractivity: 53.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 102.31
ACD/KOC (pH 5.5): 955.66
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 102.23
ACD/KOC (pH 7.4): 954.90
Polar Surface Area: 59 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 188.6±3.0 cm3

Click to predict properties on the Chemicalize site


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