ChemSpider 2D Image | MFCD01927415 | C11H16O2S

MFCD01927415

  • Molecular FormulaC11H16O2S
  • Average mass212.309 Da
  • Monoisotopic mass212.087097 Da
  • ChemSpider ID14247230

More details:

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

2-Thiophenecarboxylic acid, 5-hexyl- [ACD/Index Name]
5-Hexyl-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-HEXYL-2-THIOPHENECARBOXYLIC ACID [ACD/IUPAC Name]
90619-86-6 [RN]
Acide 5-hexyl-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
MFCD01927415
5-Hexylthiophene-2-carboxylic acid
95%

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

Density: 1.1±0.0 g/cm3
Boiling Point: 339.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 61.5±0.0 kJ/mol
Flash Point: 158.9±0.0 °C
Index of Refraction: 1.539
Molar Refractivity: 59.6±0.0 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 25.38
ACD/KOC (pH 5.5): 111.15
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 1.35
ACD/KOC (pH 7.4): 5.92
Polar Surface Area: 66 Å2
Polarizability: 23.6±0.0 10-24cm3
Surface Tension: 43.4±0.0 dyne/cm
Molar Volume: 190.3±0.0 cm3

Click to predict properties on the Chemicalize site


Advertisement