ChemSpider 2D Image | (2R,3R)-3-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxy-5-methylhexanoic acid | C22H25NO5

(2R,3R)-3-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxy-5-methylhexanoic acid

  • Molecular FormulaC22H25NO5
  • Average mass383.438 Da
  • Monoisotopic mass383.173279 Da
  • ChemSpider ID29312285

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-3-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxy-5-methylhexanoic acid [ACD/IUPAC Name]
(2R,3R)-3-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxy-5-methylhexansäure [German] [ACD/IUPAC Name]
Acide (2R,3R)-3-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}-2-hydroxy-5-méthylhexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-hydroxy-5-methyl-, (2R,3R)- [ACD/Index Name]
(2R,3R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-hydroxy-5-methylhexanoic acid
[1217603-26-3] [RN]
1217603-26-3 [RN]
1217779-00-4 [RN]
Fmoc-(2R,3R)-3-amino-2-hydroxy-5-methylhexanoic acid
Fmoc-(2R,3R)-3-amino-2-hydroxy-5-methylhexanoicacid
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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: 613.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 324.7±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 103.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 3.31
ACD/KOC (pH 5.5): 15.98
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.09
Polar Surface Area: 96 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 307.0±3.0 cm3

Click to predict properties on the Chemicalize site


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