Found 33 results

Search term: MF = 'C_{32}H_{45}NO_{6}'
ChemSpider 2D Image | (3S,4R,7S)-1-Hydroxy-7-methoxy-2,2,4-trimethyl-3-decanyl N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-alaninate | C32H45NO6

(3S,4R,7S)-1-Hydroxy-7-methoxy-2,2,4-trimethyl-3-decanyl N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-alaninate

  • Molecular FormulaC32H45NO6
  • Average mass539.703 Da
  • Monoisotopic mass539.324707 Da
  • ChemSpider ID9708735

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3S,4R,7S)-1-Hydroxy-7-methoxy-2,2,4-trimethyl-3-decanyl N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-alaninate [ACD/IUPAC Name]
(3S,4R,7S)-1-Hydroxy-7-methoxy-2,2,4-trimethyl-3-decanyl-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-alaninat [German] [ACD/IUPAC Name]
L-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, (1S,2R,5S)-1-(2-hydroxy-1,1-dimethylethyl)-5-methoxy-2-methyloctyl ester [ACD/Index Name]
N-[(9H-Fluorén-9-ylméthoxy)carbonyl]-L-alaninate de (3S,4R,7S)-1-hydroxy-7-méthoxy-2,2,4-triméthyl-3-décanyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 654.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 349.3±31.5 °C
Index of Refraction: 1.536
Molar Refractivity: 152.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 6.62
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 56322.62
ACD/KOC (pH 5.5): 87522.38
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 56280.64
ACD/KOC (pH 7.4): 87457.16
Polar Surface Area: 94 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 487.7±3.0 cm3

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