Found 109 results

Search term: MF = 'C_{29}H_{35}F_{2}N_{3}O_{3}'
ChemSpider 2D Image | 9H-Fluoren-9-ylmethyl (2S)-2-{[(3R)-3-amino-3-cyclohexyl-2,2-difluoropropyl]carbamoyl}-1-pyrrolidinecarboxylate | C29H35F2N3O3

9H-Fluoren-9-ylmethyl (2S)-2-{[(3R)-3-amino-3-cyclohexyl-2,2-difluoropropyl]carbamoyl}-1-pyrrolidinecarboxylate

  • Molecular FormulaC29H35F2N3O3
  • Average mass511.603 Da
  • Monoisotopic mass511.264648 Da
  • ChemSpider ID9050185

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-2-{[(3R)-3-Amino-3-cyclohexyl-2,2-difluoropropyl]carbamoyl}-1-pyrrolidinecarboxylate de 9H-fluorén-9-ylméthyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarboxylic acid, 2-[[[(3R)-3-amino-3-cyclohexyl-2,2-difluoropropyl]amino]carbonyl]-, 9H-fluoren-9-ylmethyl ester, (2S)- [ACD/Index Name]
9H-Fluoren-9-ylmethyl (2S)-2-{[(3R)-3-amino-3-cyclohexyl-2,2-difluoropropyl]carbamoyl}-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
9H-Fluoren-9-ylmethyl-(2S)-2-{[(3R)-3-amino-3-cyclohexyl-2,2-difluorpropyl]carbamoyl}-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 707.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.5±3.0 kJ/mol
Flash Point: 381.5±32.9 °C
Index of Refraction: 1.579
Molar Refractivity: 136.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 98.02
ACD/KOC (pH 5.5): 328.35
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2539.87
ACD/KOC (pH 7.4): 8507.70
Polar Surface Area: 85 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 410.0±3.0 cm3

Click to predict properties on the Chemicalize site


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