ChemSpider 2D Image | (S)-nafenopin | C20H22O3

(S)-nafenopin

  • Molecular FormulaC20H22O3
  • Average mass310.387 Da
  • Monoisotopic mass310.156891 Da
  • ChemSpider ID30786366

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-nafenopin
2-Methyl-2-{4-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl]phenoxy}propanoic acid [ACD/IUPAC Name]
2-Methyl-2-{4-[(1S)-1,2,3,4-tetrahydro-1-naphthalinyl]phenoxy}propansäure [German] [ACD/IUPAC Name]
Acide 2-méthyl-2-{4-[(1S)-1,2,3,4-tétrahydro-1-naphtalényl]phénoxy}propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-methyl-2-[4-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl]phenoxy]- [ACD/Index Name]
2-methyl-2-{4-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy}propanoic acid
3771-19-5 [RN]
Nafenopin
UNII-093W78U96W

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

Density: 1.2±0.1 g/cm3
Boiling Point: 466.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 164.4±18.9 °C
Index of Refraction: 1.581
Molar Refractivity: 89.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 22.08
ACD/KOC (pH 5.5): 75.19
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.08
Polar Surface Area: 47 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 268.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement