ChemSpider 2D Image | Pramiconazole | C35H39F2N7O4

Pramiconazole

  • Molecular FormulaC35H39F2N7O4
  • Average mass659.726 Da
  • Monoisotopic mass659.303162 Da
  • ChemSpider ID2281806
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

1-{4-[4-(4-{[(2S,4R)-4-(2,4-Difluorophenyl)-4-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy}phenyl)-1-piperazinyl]phenyl}-3-isopropyl-2-imidazolidinone [ACD/IUPAC Name]
1-{4-[4-(4-{[(2S,4R)-4-(2,4-Difluorophényl)-4-(1H-1,2,4-triazol-1-ylméthyl)-1,3-dioxolan-2-yl]méthoxy}phényl)-1-pipérazinyl]phényl}-3-isopropyl-2-imidazolidinone [French] [ACD/IUPAC Name]
1-{4-[4-(4-{[(2S,4R)-4-(2,4-difluorophenyl)-4-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-3-(propan-2-yl)imidazolidin-2-one
1-{4-[4-(4-{[(2S,4R)-4-(2,4-Difluorphenyl)-4-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy}phenyl)-1-piperazinyl]phenyl}-3-isopropyl-2-imidazolidinon [German] [ACD/IUPAC Name]
219923-85-0 [RN]
2-Imidazolidinone, 1-[4-[4-[4-[[(2S,4R)-4-(2,4-difluorophenyl)-4-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-3-(1-methylethyl)- [ACD/Index Name]
4SYH0R661F
8769
pramiconazol [Spanish] [INN]
pramiconazole [French] [INN]
More...

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

R126638 [DBID]
AIDS221829 [DBID]
AIDS-221829 [DBID]
R-126638 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 812.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.1±3.0 kJ/mol
Flash Point: 445.0±37.1 °C
Index of Refraction: 1.650
Molar Refractivity: 176.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 40.77
ACD/KOC (pH 5.5): 196.45
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 786.91
ACD/KOC (pH 7.4): 3791.93
Polar Surface Area: 88 Å2
Polarizability: 70.1±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 484.6±7.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form