ChemSpider 2D Image | (3Z)-4-Phenyl-3-butenethioic S-acid | C10H10OS

(3Z)-4-Phenyl-3-butenethioic S-acid

  • Molecular FormulaC10H10OS
  • Average mass178.251 Da
  • Monoisotopic mass178.045242 Da
  • ChemSpider ID35802734

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-4-Phenyl-3-butenethioic S-acid [ACD/IUPAC Name]
(3Z)-4-Phenyl-3-butenthio-S-säure [German] [ACD/IUPAC Name]
3-Butenethioic acid, 4-phenyl-, (3Z)- [ACD/Index Name]
S-Acide de (3Z)-4-phényl-3-butènethioïque [French] [ACD/IUPAC Name]
(Z)-Styrylthioacetic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 309.3±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 140.8±24.8 °C
Index of Refraction: 1.609
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 1.04
ACD/KOC (pH 5.5): 11.78
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 158.1±3.0 cm3

Click to predict properties on the Chemicalize site


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