ChemSpider 2D Image | (2Z)-2-{[4-(3,4-Dichlorophenyl)-1,3-thiazol-2-yl]hydrazono}-3-(3-nitrophenyl)propanoic acid | C18H12Cl2N4O4S

(2Z)-2-{[4-(3,4-Dichlorophenyl)-1,3-thiazol-2-yl]hydrazono}-3-(3-nitrophenyl)propanoic acid

  • Molecular FormulaC18H12Cl2N4O4S
  • Average mass451.283 Da
  • Monoisotopic mass449.995636 Da
  • ChemSpider ID58135555

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-{[4-(3,4-Dichlorophenyl)-1,3-thiazol-2-yl]hydrazono}-3-(3-nitrophenyl)propanoic acid [ACD/IUPAC Name]
(2Z)-2-{[4-(3,4-Dichlorphenyl)-1,3-thiazol-2-yl]hydrazono}-3-(3-nitrophenyl)propansäure [German] [ACD/IUPAC Name]
Acide (2Z)-2-{[4-(3,4-dichlorophényl)-1,3-thiazol-2-yl]hydrazono}-3-(3-nitrophényl)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-[2-[4-(3,4-dichlorophenyl)-2-thiazolyl]hydrazinylidene]-3-nitro-, (αZ)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 687.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 369.7±34.3 °C
Index of Refraction: 1.714
Molar Refractivity: 111.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.54
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 6.45
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.31
Polar Surface Area: 149 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 283.8±7.0 cm3

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