ChemSpider 2D Image | Fmoc-Cys(DMT)-OH | C39H35NO6S

Fmoc-Cys(DMT)-OH

  • Molecular FormulaC39H35NO6S
  • Average mass645.763 Da
  • Monoisotopic mass645.218506 Da
  • ChemSpider ID23089457

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Cysteine, S-[bis(4-methoxyphenyl)phenylmethyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]- [ACD/Index Name]
Fmoc-Cys(DMT)-OH
S-[Bis(4-methoxyphenyl)(phenyl)methyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-cystein [German] [ACD/IUPAC Name]
S-[Bis(4-methoxyphenyl)(phenyl)methyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-cysteine [ACD/IUPAC Name]
S-[Bis(4-méthoxyphényl)(phényl)méthyl]-N-[(9H-fluorén-9-ylméthoxy)carbonyl]-D-cystéine [French] [ACD/IUPAC Name]
MFCD08705368 [MDL number]

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

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

Density: 1.3±0.1 g/cm3
Boiling Point: 813.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.9±3.0 kJ/mol
Flash Point: 445.6±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 182.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 9.79
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 6007.00
ACD/KOC (pH 5.5): 3556.67
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 370.73
ACD/KOC (pH 7.4): 219.50
Polar Surface Area: 119 Å2
Polarizability: 72.4±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 508.9±3.0 cm3

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