ChemSpider 2D Image | 4221286 | C37H31NO4S

4221286

  • Molecular FormulaC37H31NO4S
  • Average mass585.711 Da
  • Monoisotopic mass585.197388 Da
  • ChemSpider ID113695
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-3-(tritylsulfanyl)propanoic acid
103213-32-7 [RN]
4221286
Cysteine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-S-(triphenylmethyl)- [ACD/Index Name]
Fmoc-Cys(trt) )-OH
Fmoc-Cys(Trt)-OH
FMOC-S-trityl-L-cysteine
MFCD00038538 [MDL number]
N-(9-Fluorenyl methoxy carbonyl)-S-trityl-L-cysteine
N-(9-Fluorenylmethoxycarbonyl)-S-trityl-L-cysteine
More...

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

08503_FLUKA [DBID]
47695_FLUKA [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 763.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.6±3.0 kJ/mol
Flash Point: 415.5±32.9 °C
Index of Refraction: 1.656
Molar Refractivity: 169.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 9.96
ACD/LogD (pH 5.5): 6.17
ACD/BCF (pH 5.5): 8548.13
ACD/KOC (pH 5.5): 5405.52
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 342.18
ACD/KOC (pH 7.4): 216.38
Polar Surface Area: 101 Å2
Polarizability: 67.2±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 460.9±3.0 cm3

Click to predict properties on the Chemicalize site






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