ChemSpider 2D Image | 3-(2,3-Dimethoxyphenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid | C26H25NO6

3-(2,3-Dimethoxyphenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

  • Molecular FormulaC26H25NO6
  • Average mass447.480 Da
  • Monoisotopic mass447.168182 Da
  • ChemSpider ID20193973

More details:






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

3-(2,3-Dimethoxyphenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid [ACD/IUPAC Name]
3-(2,3-Dimethoxyphenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propansäure [German] [ACD/IUPAC Name]
Acide 3-(2,3-diméthoxyphényl)-3-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,3-dimethoxy- [ACD/Index Name]
284491-99-2 [RN]
3-(2,3-DIMETHOXYPHENYL)-3-([(9H-FLUOREN-9-YLMETHOXY)CARBONYL]AMINO)PROPANOIC ACID
3-(2,3-dimethoxyphenyl)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
501015-36-7 [RN]
511272-39-2 [RN]
MFCD02090646
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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: 666.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 356.7±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 121.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 78.32
ACD/KOC (pH 5.5): 336.94
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 1.31
ACD/KOC (pH 7.4): 5.64
Polar Surface Area: 94 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 351.8±3.0 cm3

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