ChemSpider 2D Image | (2E,4Z)-2-Cyano-5-(4-methoxyphenyl)-2,4-pentadienethioamide | C13H12N2OS

(2E,4Z)-2-Cyano-5-(4-methoxyphenyl)-2,4-pentadienethioamide

  • Molecular FormulaC13H12N2OS
  • Average mass244.312 Da
  • Monoisotopic mass244.067032 Da
  • ChemSpider ID30652271

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4Z)-2-Cyan-5-(4-methoxyphenyl)-2,4-pentadienthioamid [German] [ACD/IUPAC Name]
(2E,4Z)-2-Cyano-5-(4-methoxyphenyl)-2,4-pentadienethioamide [ACD/IUPAC Name]
(2E,4Z)-2-Cyano-5-(4-méthoxyphényl)-2,4-pentadiènethioamide [French] [ACD/IUPAC Name]
2,4-Pentadienethioamide, 2-cyano-5-(4-methoxyphenyl)-, (2E,4Z)- [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: 456.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.7±3.0 kJ/mol
Flash Point: 230.1±31.5 °C
Index of Refraction: 1.657
Molar Refractivity: 73.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 28.74
ACD/KOC (pH 5.5): 385.07
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.74
ACD/KOC (pH 7.4): 385.07
Polar Surface Area: 91 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 199.4±3.0 cm3

Click to predict properties on the Chemicalize site


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