ChemSpider 2D Image | Methyl 3-amino-4-hydroxy-5-methoxybenzoate | C9H11NO4

Methyl 3-amino-4-hydroxy-5-methoxybenzoate

  • Molecular FormulaC9H11NO4
  • Average mass197.188 Da
  • Monoisotopic mass197.068802 Da
  • ChemSpider ID22178165

More details:






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

3-Amino-4-hydroxy-5-méthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-amino-4-hydroxy-5-methoxy-, methyl ester [ACD/Index Name]
Methyl 3-amino-4-hydroxy-5-methoxybenzoate [ACD/IUPAC Name]
Methyl-3-amino-4-hydroxy-5-methoxybenzoat [German] [ACD/IUPAC Name]
[92643-72-6]
2-Amino-6-methoxy-4-(methoxycarbonyl)phenol, 2-Hydroxy-3-methoxy-5-(methoxycarbonyl)aniline
2-Amino-6-methoxy-4-(methoxycarbonyl)phenol; 2-Hydroxy-3-methoxy-5-(methoxycarbonyl)aniline
3-Amino-4-hydroxy-5-methoxy-benzoic acid methyl ester
92643-72-6 [RN]
Methyl 3-amino-4-hydroxy-5-methoxybenzenecarboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 362.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.3±3.0 kJ/mol
Flash Point: 173.3±27.9 °C
Index of Refraction: 1.583
Molar Refractivity: 50.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 76.16
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 2.62
ACD/KOC (pH 7.4): 66.53
Polar Surface Area: 82 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 152.0±3.0 cm3

Click to predict properties on the Chemicalize site






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