ChemSpider 2D Image | (R)-Butibufen | C14H20O2

(R)-Butibufen

  • Molecular FormulaC14H20O2
  • Average mass220.307 Da
  • Monoisotopic mass220.146332 Da
  • ChemSpider ID29782580

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-(4-Isobutylphenyl)butanoic acid [ACD/IUPAC Name]
(2R)-2-(4-Isobutylphenyl)butansäure [German] [ACD/IUPAC Name]
(R)-Butibufen
254886-68-5 [RN]
Acide (2R)-2-(4-isobutylphényl)butanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-ethyl-4-(2-methylpropyl)-, (αR)- [ACD/Index Name]
(2R)-2-[4-(2-methylpropyl)phenyl]butanoic acid
(a-R)-a-Ethyl-4-(2-methylpropyl)benzeneacetic acid
(R)-2-(4-isobutylphenyl)butanoic acid
259-849-2 [EINECS]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3993I971I5 [DBID]
UNII:3993I971I5 [DBID]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 335.1±11.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.0±3.0 kJ/mol
    Flash Point: 232.1±14.4 °C
    Index of Refraction: 1.515
    Molar Refractivity: 65.4±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.25
    ACD/LogD (pH 5.5): 2.79
    ACD/BCF (pH 5.5): 42.08
    ACD/KOC (pH 5.5): 242.65
    ACD/LogD (pH 7.4): 1.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.87
    Polar Surface Area: 37 Å2
    Polarizability: 25.9±0.5 10-24cm3
    Surface Tension: 37.7±3.0 dyne/cm
    Molar Volume: 216.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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