ChemSpider 2D Image | Fmoc-(4-aminophenylthio)acetic acid | C23H19NO4S

Fmoc-(4-aminophenylthio)acetic acid

  • Molecular FormulaC23H19NO4S
  • Average mass405.466 Da
  • Monoisotopic mass405.103485 Da
  • ChemSpider ID26051541

More details:

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

[(4-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}phenyl)sulfanyl]acetic acid [ACD/IUPAC Name]
[(4-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}phenyl)sulfanyl]essigsäure [German] [ACD/IUPAC Name]
1185301-10-3 [RN]
2-[[4-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]phenyl]thio]acetic acid
Acetic acid, 2-[[4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]phenyl]thio]- [ACD/Index Name]
Acide [(4-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}phényl)sulfanyl]acétique [French] [ACD/IUPAC Name]
Fmoc-(4-aminophenylthio)acetic acid
MFCD02682318 [MDL number]
2-((4-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)phenyl)thio)acetic acid
2-[4-(9H-fluoren-9-ylmethoxycarbonylamino)phenyl]sulfanylacetic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 591.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 311.3±27.3 °C
Index of Refraction: 1.701
Molar Refractivity: 112.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.00
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 38.14
ACD/KOC (pH 5.5): 136.22
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 1.01
ACD/KOC (pH 7.4): 3.63
Polar Surface Area: 101 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 70.8±5.0 dyne/cm
Molar Volume: 290.6±5.0 cm3

Click to predict properties on the Chemicalize site


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