ChemSpider 2D Image | 3-{[(2-Aminoethyl)sulfanyl](3-ethylphenyl)phenylmethyl}phenol | C23H25NOS

3-{[(2-Aminoethyl)sulfanyl](3-ethylphenyl)phenylmethyl}phenol

  • Molecular FormulaC23H25NOS
  • Average mass363.516 Da
  • Monoisotopic mass363.165680 Da
  • ChemSpider ID29412816

More details:

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

3-{[(2-Aminoethyl)sulfanyl](3-ethylphenyl)phenylmethyl}phenol [German] [ACD/IUPAC Name]
3-{[(2-Aminoethyl)sulfanyl](3-ethylphenyl)phenylmethyl}phenol [ACD/IUPAC Name]
3-{[(2-Aminoéthyl)sulfanyl](3-éthylphényl)phénylméthyl}phénol [French] [ACD/IUPAC Name]
Phenol, 3-[[(2-aminoethyl)thio](3-ethylphenyl)phenylmethyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 509.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 261.8±30.1 °C
Index of Refraction: 1.629
Molar Refractivity: 111.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.63
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 4.64
ACD/KOC (pH 5.5): 15.82
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 141.04
ACD/KOC (pH 7.4): 480.84
Polar Surface Area: 72 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 314.7±3.0 cm3

Click to predict properties on the Chemicalize site


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