ChemSpider 2D Image | 3,7,11-Trimethyl-2,6,10-dodecatriene-1-thiol | C15H26S

3,7,11-Trimethyl-2,6,10-dodecatriene-1-thiol

  • Molecular FormulaC15H26S
  • Average mass238.432 Da
  • Monoisotopic mass238.175522 Da
  • ChemSpider ID26538165

More details:

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

2,6,10-Dodecatriene-1-thiol, 3,7,11-trimethyl- [ACD/Index Name]
3,7,11-Trimethyl-2,6,10-dodecatrien-1-thiol [German] [ACD/IUPAC Name]
3,7,11-Trimethyl-2,6,10-dodecatriene-1-thiol [ACD/IUPAC Name]
3,7,11-Triméthyl-2,6,10-dodécatriène-1-thiol [French] [ACD/IUPAC Name]
7226-85-9 [RN]
(E,E)-Farnesyl Thiol
(E,E)-Farnesyl Thiol Preparation Kit
138077-74-4 [RN]
2,6,10-Dodecatriene-1-thiol, 3,7,11-trimethyl-, (E,E)-

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

Density: 0.9±0.1 g/cm3
Boiling Point: 334.0±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 136.2±12.3 °C
Index of Refraction: 1.497
Molar Refractivity: 79.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 6.15
ACD/BCF (pH 5.5): 27644.97
ACD/KOC (pH 5.5): 52588.41
ACD/LogD (pH 7.4): 6.15
ACD/BCF (pH 7.4): 27581.27
ACD/KOC (pH 7.4): 52467.24
Polar Surface Area: 39 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 29.6±3.0 dyne/cm
Molar Volume: 270.4±3.0 cm3

Click to predict properties on the Chemicalize site


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