ChemSpider 2D Image | [(2-Methyl-2-undecanyl)sulfanyl]acetic acid | C14H28O2S

[(2-Methyl-2-undecanyl)sulfanyl]acetic acid

  • Molecular FormulaC14H28O2S
  • Average mass260.436 Da
  • Monoisotopic mass260.181000 Da
  • ChemSpider ID34996903

More details:

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

[(2-Methyl-2-undecanyl)sulfanyl]acetic acid [ACD/IUPAC Name]
[(2-Methyl-2-undecanyl)sulfanyl]essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[(1,1-dimethyldecyl)thio]- [ACD/Index Name]
Acide [(2-méthyl-2-undécanyl)sulfanyl]acétique [French] [ACD/IUPAC Name]
(tert-dodecylthio)acetic acid
[(2-METHYLUNDECAN-2-YL)SULFANYL]ACETIC ACID
29657-33-8 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 363.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 173.8±23.2 °C
Index of Refraction: 1.482
Molar Refractivity: 76.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 291.94
ACD/KOC (pH 5.5): 692.15
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 6.00
ACD/KOC (pH 7.4): 14.22
Polar Surface Area: 63 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 268.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement