Found 5 results

Search term: VTDRHDRSYRSZJX (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-(3-Cyanophenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid | C25H20N2O4

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

  • Molecular FormulaC25H20N2O4
  • Average mass412.437 Da
  • Monoisotopic mass412.142303 Da
  • ChemSpider ID21392235

More details:

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

3-(3-Cyanophenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid [ACD/IUPAC Name]
3-(3-Cyanphenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propansäure [German] [ACD/IUPAC Name]
Acide 3-(3-cyanophényl)-3-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 3-cyano-β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]- [ACD/Index Name]
3-(3-CYANO-PHENYL)-3-([(9H-FLUOREN-9-YLMETHOXY)CARBONYL]AMINO) PROPANOIC ACID
3-(3-cyanophenyl)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
3-(3-Cyano-phenyl)-3-(9H-fluoren-9-ylmethoxy)carbonyl]amino) propanoic acid
507472-23-3 [RN]
517905-91-8 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 659.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.0±3.0 kJ/mol
Flash Point: 352.8±31.5 °C
Index of Refraction: 1.672
Molar Refractivity: 113.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 39.43
ACD/KOC (pH 5.5): 181.83
ACD/LogD (pH 7.4): 1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.36
Polar Surface Area: 99 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 70.3±5.0 dyne/cm
Molar Volume: 303.3±5.0 cm3

Click to predict properties on the Chemicalize site


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