ChemSpider 2D Image | RS 100235 | C27H35ClN2O5

RS 100235

  • Molecular FormulaC27H35ClN2O5
  • Average mass503.030 Da
  • Monoisotopic mass502.223450 Da
  • ChemSpider ID4470905

More details:

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

1-(8-Amino-7-chlor-2,3-dihydro-1,4-benzodioxin-5-yl)-3-{1-[3-(3,4-dimethoxyphenyl)propyl]-4-piperidinyl}-1-propanon [German] [ACD/IUPAC Name]
1-(8-Amino-7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-3-{1-[3-(3,4-dimethoxyphenyl)propyl]-4-piperidinyl}-1-propanone [ACD/IUPAC Name]
1-(8-Amino-7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-3-{1-[3-(3,4-diméthoxyphényl)propyl]-4-pipéridinyl}-1-propanone [French] [ACD/IUPAC Name]
1-(8-amino-7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-3-{1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl}propan-1-one
1-Propanone, 1-(8-amino-7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]-4-piperidinyl]- [ACD/Index Name]
RS 100235
1-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl]propan-1-one
1-(8-Amino-7-chloro-2,3-dihydro-benzo[1,4]dioxin-5-yl)-3-{1-[3-(3,4-dimethoxy-phenyl)-propyl]-piperidin-4-yl}-propan-1-one
171859-02-2 [RN]
RS100235
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point: 667.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 357.3±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 137.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 3.26
ACD/KOC (pH 5.5): 11.08
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 35.41
ACD/KOC (pH 7.4): 120.40
Polar Surface Area: 83 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 416.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement