ChemSpider 2D Image | 2,5-DIMETHOXY-4-PHENYLTHIOAMPHETAMINE | C17H21NO2S

2,5-DIMETHOXY-4-PHENYLTHIOAMPHETAMINE

  • Molecular FormulaC17H21NO2S
  • Average mass303.419 Da
  • Monoisotopic mass303.129303 Da
  • ChemSpider ID23552980

More details:






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

1-[2,5-Dimethoxy-4-(phenylsulfanyl)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
1-[2,5-Dimethoxy-4-(phenylsulfanyl)phenyl]-2-propanamine [ACD/IUPAC Name]
1-[2,5-Diméthoxy-4-(phénylsulfanyl)phényl]-2-propanamine [French] [ACD/IUPAC Name]
2,5-DIMETHOXY-4-PHENYLTHIOAMPHETAMINE
952006-44-9 [RN]
Benzeneethanamine, 2,5-dimethoxy-α-methyl-4-(phenylthio)- [ACD/Index Name]
Aleph-6 [Wiki]

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

3961V7J60A [DBID]
UNII:3961V7J60A [DBID]

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

Density: 1.2±0.0 g/cm3
Boiling Point: 441.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 69.9±0.0 kJ/mol
Flash Point: 220.7±0.0 °C
Index of Refraction: 1.602
Molar Refractivity: 89.7±0.0 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.51
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 3.78
ACD/KOC (pH 7.4): 22.97
Polar Surface Area: 70 Å2
Polarizability: 35.6±0.0 10-24cm3
Surface Tension: 49.4±0.0 dyne/cm
Molar Volume: 261.5±0.0 cm3

Click to predict properties on the Chemicalize site






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