ChemSpider 2D Image | ({(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-pyrrolidinyl}methoxy)acetic acid | C22H23NO5

({(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-pyrrolidinyl}methoxy)acetic acid

  • Molecular FormulaC22H23NO5
  • Average mass381.422 Da
  • Monoisotopic mass381.157623 Da
  • ChemSpider ID114452514

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

({(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-pyrrolidinyl}methoxy)acetic acid [ACD/IUPAC Name]
({(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-pyrrolidinyl}methoxy)essigsäure [German] [ACD/IUPAC Name]
1-Pyrrolidinecarboxylic acid, 2-[(carboxymethoxy)methyl]-, 1-(9H-fluoren-9-ylmethyl) ester, (2S)- [ACD/Index Name]
Acide ({(2S)-1-[(9H-fluorén-9-ylméthoxy)carbonyl]-2-pyrrolidinyl}méthoxy)acétique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 595.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 313.7±23.2 °C
Index of Refraction: 1.604
Molar Refractivity: 102.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 2.90
ACD/KOC (pH 5.5): 19.67
ACD/LogD (pH 7.4): 0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 296.8±3.0 cm3

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