ChemSpider 2D Image | 3-tert-Butoxycarbonylamino-2-(3,4-dimethoxy-phenyl)-propionic acid | C16H23NO6

3-tert-Butoxycarbonylamino-2-(3,4-dimethoxy-phenyl)-propionic acid

  • Molecular FormulaC16H23NO6
  • Average mass325.357 Da
  • Monoisotopic mass325.152527 Da
  • ChemSpider ID21107736

More details:

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

2-(3,4-Dimethoxyphenyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propansäure [German] [ACD/IUPAC Name]
3-tert-Butoxycarbonylamino-2-(3,4-dimethoxy-phenyl)-propionic acid
Acide 2-(3,4-diméthoxyphényl)-3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)propanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-3,4-dimethoxy- [ACD/Index Name]
[683218-93-1] [RN]
2-(3,4-dimethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
3-((tert-Butoxycarbonyl)amino)-2-(3,4-dimethoxyphenyl)propanoic acid
3-((tert-Butoxycarbonyl)amino)-2-(3,4-dimethoxyphenyl)propanoicacid
3-[(TERT-BUTOXYCARBONYL)AMINO]-2-(3,4-DIMETHOXYPHENYL)PROPANOIC ACID
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 485.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 247.6±28.7 °C
Index of Refraction: 1.517
Molar Refractivity: 83.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.60
ACD/LogD (pH 7.4): -1.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 277.0±3.0 cm3

Click to predict properties on the Chemicalize site


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