Found 17 results

Search term: MF = 'C_{27}H_{29}N_{5}S_{2}'
ChemSpider 2D Image | (2Z)-2-{[1-(4-Butylphenyl)-3-(2-thienyl)-1H-pyrazol-4-yl]methylene}-N-(4-ethylphenyl)hydrazinecarbothioamide | C27H29N5S2

(2Z)-2-{[1-(4-Butylphenyl)-3-(2-thienyl)-1H-pyrazol-4-yl]methylene}-N-(4-ethylphenyl)hydrazinecarbothioamide

  • Molecular FormulaC27H29N5S2
  • Average mass487.683 Da
  • Monoisotopic mass487.186432 Da
  • ChemSpider ID76013827

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-{[1-(4-Butylphenyl)-3-(2-thienyl)-1H-pyrazol-4-yl]methylen}-N-(4-ethylphenyl)hydrazincarbothioamid [German] [ACD/IUPAC Name]
(2Z)-2-{[1-(4-Butylphenyl)-3-(2-thienyl)-1H-pyrazol-4-yl]methylene}-N-(4-ethylphenyl)hydrazinecarbothioamide [ACD/IUPAC Name]
(2Z)-2-{[1-(4-Butylphényl)-3-(2-thiényl)-1H-pyrazol-4-yl]méthylène}-N-(4-éthylphényl)hydrazinecarbothioamide [French] [ACD/IUPAC Name]
Hydrazinecarbothioamide, 2-[[1-(4-butylphenyl)-3-(2-thienyl)-1H-pyrazol-4-yl]methylene]-N-(4-ethylphenyl)-, (2Z)- [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: 634.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.7±34.3 °C
Index of Refraction: 1.652
Molar Refractivity: 147.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 9.37
ACD/LogD (pH 5.5): 7.31
ACD/BCF (pH 5.5): 212430.14
ACD/KOC (pH 5.5): 226355.31
ACD/LogD (pH 7.4): 7.31
ACD/BCF (pH 7.4): 211683.00
ACD/KOC (pH 7.4): 225559.19
Polar Surface Area: 115 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 403.8±7.0 cm3

Click to predict properties on the Chemicalize site


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