ChemSpider 2D Image | (R)-4-AMINO-3-(4-FLUOROPHENYL)BUTANOIC ACID | C10H12FNO2

(R)-4-AMINO-3-(4-FLUOROPHENYL)BUTANOIC ACID

  • Molecular FormulaC10H12FNO2
  • Average mass197.206 Da
  • Monoisotopic mass197.085205 Da
  • ChemSpider ID23147298

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-4-Amino-3-(4-fluorophenyl)butanoic acid [ACD/IUPAC Name]
(3R)-4-Amino-3-(4-fluorphenyl)butansäure [German] [ACD/IUPAC Name]
(R)-4-AMINO-3-(4-FLUOROPHENYL)BUTANOIC ACID
741217-33-4 [RN]
Acide (3R)-4-amino-3-(4-fluorophényl)butanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-(aminomethyl)-4-fluoro-, (βR)- [ACD/Index Name]
(3R)-4-azaniumyl-3-(4-fluorophenyl)butanoate
(R)-4-Amino-3-(4-Fluorophenyl)butanoic Acid (en)
(R)-4-amino-3-(4-fluorophenyl)butanoicacid
(S)-4-AMINO-3-(4-FLUOROPHENYL)BUTANOIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 329.1±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.3±3.0 kJ/mol
    Flash Point: 152.9±25.1 °C
    Index of Refraction: 1.546
    Molar Refractivity: 50.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.02
    ACD/LogD (pH 5.5): -1.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.48
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 49.3±3.0 dyne/cm
    Molar Volume: 158.5±3.0 cm3

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