ChemSpider 2D Image | (S)-N-Fmoc-alpha-(4-pentenyl)alanine | C23H25NO4

(S)-N-Fmoc-α-(4-pentenyl)alanine

  • Molecular FormulaC23H25NO4
  • Average mass379.449 Da
  • Monoisotopic mass379.178345 Da
  • ChemSpider ID24590180

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-methyl-6-heptenoic acid [ACD/IUPAC Name]
(2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-methyl-6-heptensäure [German] [ACD/IUPAC Name]
(2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-2-methylhept-6-enoic acid
(S)-2-{[(9H-Fluoren-9-yl)methoxy]carbonylamino}-2-methylhept-6-enoic acid
(S)-N-Fmoc-α-(4-pentenyl)alanine
288617-73-2 [RN]
6-Heptenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-methyl-, (2S)- [ACD/Index Name]
Acide (2S)-2-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}-2-méthyl-6-hepténoïque [French] [ACD/IUPAC Name]
L B656 HHJ H1OVMX1&VQ4U1 [WLN]
N-Fmo​c-α-(​4-Penteny​l)-L-alanine
More...
  • Miscellaneous

    • Safety:

      H302+H312+H332 W&J PharmaChem, Inc. 201167
      P302+P352+P304+P312+P503+P351+P338+P403+P235+P280+P260 W&J PharmaChem, Inc. 201167

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

Density: 1.2±0.1 g/cm3
Boiling Point: 591.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 311.7±28.7 °C
Index of Refraction: 1.582
Molar Refractivity: 106.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 36.74
ACD/KOC (pH 5.5): 130.92
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.57
Polar Surface Area: 76 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 320.0±3.0 cm3

Click to predict properties on the Chemicalize site


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