ChemSpider 2D Image | 1-[(1R)-1,2,3,4-Tetrahydro-1-naphthalenylamino]-3-(2-thienylmethoxy)-2-propanol | C18H23NO2S

1-[(1R)-1,2,3,4-Tetrahydro-1-naphthalenylamino]-3-(2-thienylmethoxy)-2-propanol

  • Molecular FormulaC18H23NO2S
  • Average mass317.446 Da
  • Monoisotopic mass317.144958 Da
  • ChemSpider ID70688987

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

1-[(1R)-1,2,3,4-Tétrahydro-1-naphtalénylamino]-3-(2-thiénylméthoxy)-2-propanol [French] [ACD/IUPAC Name]
1-[(1R)-1,2,3,4-Tetrahydro-1-naphthalenylamino]-3-(2-thienylmethoxy)-2-propanol [ACD/IUPAC Name]
1-[(1R)-1,2,3,4-Tetrahydro-1-naphthalinylamino]-3-(2-thienylmethoxy)-2-propanol [German] [ACD/IUPAC Name]
2-Propanol, 1-[[(1R)-1,2,3,4-tetrahydro-1-naphthalenyl]amino]-3-(2-thienylmethoxy)- [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: 507.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 260.7±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 91.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.51
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 48.70
ACD/KOC (pH 7.4): 323.96
Polar Surface Area: 70 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 264.5±5.0 cm3

Click to predict properties on the Chemicalize site


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