ChemSpider 2D Image | 2-cyano-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]acrylamide | C21H24N4O2

2-cyano-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]acrylamide

  • Molecular FormulaC21H24N4O2
  • Average mass364.441 Da
  • Monoisotopic mass364.189911 Da
  • ChemSpider ID20064865

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-Cyan-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]acrylamid [German] [ACD/IUPAC Name]
(2E)-2-Cyano-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]acrylamide [ACD/IUPAC Name]
(2E)-2-Cyano-N-cycloheptyl-3-[3-(4-méthoxyphényl)-1H-pyrazol-4-yl]acrylamide [French] [ACD/IUPAC Name]
2-cyano-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]acrylamide
2-Propenamide, 2-cyano-N-cycloheptyl-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-, (2E)- [ACD/Index Name]
FGQPNVSSEWTFSY-VBKFSLOCSA-N

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

Density: 1.2±0.1 g/cm3
Boiling Point: 674.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.1±3.0 kJ/mol
Flash Point: 361.8±31.5 °C
Index of Refraction: 1.601
Molar Refractivity: 101.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 258.85
ACD/KOC (pH 5.5): 1857.20
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 258.82
ACD/KOC (pH 7.4): 1857.04
Polar Surface Area: 91 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 297.0±5.0 cm3

Click to predict properties on the Chemicalize site


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