ChemSpider 2D Image | 4-Ethylcycloheptanethiol | C9H18S

4-Ethylcycloheptanethiol

  • Molecular FormulaC9H18S
  • Average mass158.304 Da
  • Monoisotopic mass158.112915 Da
  • ChemSpider ID48390478

More details:

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

4-Ethylcycloheptanethiol [ACD/IUPAC Name]
4-Éthylcycloheptanethiol [French] [ACD/IUPAC Name]
4-Ethylcycloheptanthiol [German] [ACD/IUPAC Name]
Cycloheptanethiol, 4-ethyl- [ACD/Index Name]
1492291-24-3 [RN]
4-ethylcycloheptane-1-thiol
MFCD21125277

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

Density: 0.9±0.1 g/cm3
Boiling Point: 216.7±9.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.5±3.0 kJ/mol
Flash Point: 77.2±16.7 °C
Index of Refraction: 1.480
Molar Refractivity: 49.5±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 360.08
ACD/KOC (pH 5.5): 2352.20
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 359.98
ACD/KOC (pH 7.4): 2351.57
Polar Surface Area: 39 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 30.6±5.0 dyne/cm
Molar Volume: 174.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement