ChemSpider 2D Image | S-(4-Acetyl-3-hydroxy-2-propylphenyl) 2-methylpropanethioate | C15H20O3S

S-(4-Acetyl-3-hydroxy-2-propylphenyl) 2-methylpropanethioate

  • Molecular FormulaC15H20O3S
  • Average mass280.383 Da
  • Monoisotopic mass280.113312 Da
  • ChemSpider ID24751161

More details:

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

2-Méthylpropanethioate de S-(4-acétyl-3-hydroxy-2-propylphényle) [French] [ACD/IUPAC Name]
Propanethioic acid, 2-methyl-, S-(4-acetyl-3-hydroxy-2-propylphenyl) ester [ACD/Index Name]
S-(4-Acetyl-3-hydroxy-2-propylphenyl) 2-methylpropanethioate [ACD/IUPAC Name]
S-(4-Acetyl-3-hydroxy-2-propylphenyl)-2-methylpropanthioat [German] [ACD/IUPAC Name]
1-[(4-acetyl-3-hydroxy-2-propylphenyl)sulfanyl]-2-methylpropan-1-one
1215610-92-6 [RN]
1-acetyl-2-hydroxy-4-(2-methylpropanoylthio)-3-propylbenzene
MFCD12963760 [MDL number]
S-(4-Acetyl-3-hydroxy-2-propylphenyl)-2-methylpropanethioate
TS-00975

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 415.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.4±3.0 kJ/mol
    Flash Point: 205.0±28.7 °C
    Index of Refraction: 1.558
    Molar Refractivity: 78.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.77
    ACD/LogD (pH 5.5): 4.31
    ACD/BCF (pH 5.5): 1107.09
    ACD/KOC (pH 5.5): 5255.56
    ACD/LogD (pH 7.4): 4.31
    ACD/BCF (pH 7.4): 1101.77
    ACD/KOC (pH 7.4): 5230.30
    Polar Surface Area: 80 Å2
    Polarizability: 31.0±0.5 10-24cm3
    Surface Tension: 47.4±5.0 dyne/cm
    Molar Volume: 242.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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