ChemSpider 2D Image | 3-Amino-3-(2-bromo-5-methoxyphenyl)propanoic acid | C10H12BrNO3

3-Amino-3-(2-bromo-5-methoxyphenyl)propanoic acid

  • Molecular FormulaC10H12BrNO3
  • Average mass274.111 Da
  • Monoisotopic mass273.000061 Da
  • ChemSpider ID26283926

More details:

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

3-Amino-3-(2-brom-5-methoxyphenyl)propansäure [German] [ACD/IUPAC Name]
3-Amino-3-(2-bromo-5-methoxyphenyl)propanoic acid [ACD/IUPAC Name]
3-AMINO-3-(2-BROMO-5-METHOXY-PHENYL)-PROPIONIC ACID
773116-92-0 [RN]
Acide 3-amino-3-(2-bromo-5-méthoxyphényl)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-amino-2-bromo-5-methoxy- [ACD/Index Name]
3-AMINO-3-(2-BROMO-5-METHOXY-PHENYL)-PROPIONICACID
BENZENEPROPANOIC ACID, B-AMINO-2-BROMO-5-METHOXY-
MFCD06206600

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 405.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.3±3.0 kJ/mol
    Flash Point: 199.1±28.7 °C
    Index of Refraction: 1.588
    Molar Refractivity: 59.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.86
    ACD/LogD (pH 5.5): -1.06
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 73 Å2
    Polarizability: 23.7±0.5 10-24cm3
    Surface Tension: 53.0±3.0 dyne/cm
    Molar Volume: 178.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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