ChemSpider 2D Image | (3Z)-6-Chloro-3-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-4H-thiochromen-4-one | C19H17ClO4S

(3Z)-6-Chloro-3-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-4H-thiochromen-4-one

  • Molecular FormulaC19H17ClO4S
  • Average mass376.854 Da
  • Monoisotopic mass376.053619 Da
  • ChemSpider ID22847112

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-6-Chlor-3-(3,4,5-trimethoxybenzyliden)-2,3-dihydro-4H-thiochromen-4-on [German] [ACD/IUPAC Name]
(3Z)-6-Chloro-3-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-4H-thiochromen-4-one [ACD/IUPAC Name]
(3Z)-6-Chloro-3-(3,4,5-triméthoxybenzylidène)-2,3-dihydro-4H-thiochromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzothiopyran-4-one, 6-chloro-2,3-dihydro-3-[(3,4,5-trimethoxyphenyl)methylene]-, (3Z)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 555.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 290.0±30.1 °C
Index of Refraction: 1.640
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1716.43
ACD/KOC (pH 5.5): 7193.54
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1716.43
ACD/KOC (pH 7.4): 7193.54
Polar Surface Area: 70 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 284.0±3.0 cm3

Click to predict properties on the Chemicalize site


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