ChemSpider 2D Image | (3S,4S)-1-[(4,4-Diethyl-2,5-dioxo-1-imidazolidinyl)acetyl]-4-(trifluoromethyl)-3-pyrrolidinecarboxylic acid | C15H20F3N3O5

(3S,4S)-1-[(4,4-Diethyl-2,5-dioxo-1-imidazolidinyl)acetyl]-4-(trifluoromethyl)-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC15H20F3N3O5
  • Average mass379.332 Da
  • Monoisotopic mass379.135498 Da
  • ChemSpider ID54839560

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-1-[(4,4-Diethyl-2,5-dioxo-1-imidazolidinyl)acetyl]-4-(trifluormethyl)-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
(3S,4S)-1-[(4,4-Diethyl-2,5-dioxo-1-imidazolidinyl)acetyl]-4-(trifluoromethyl)-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[2-(4,4-diethyl-2,5-dioxo-1-imidazolidinyl)acetyl]-4-(trifluoromethyl)-, (3S,4S)- [ACD/Index Name]
Acide (3S,4S)-1-[2-(4,4-diéthyl-2,5-dioxo-1-imidazolidinyl)acétyl]-4-(trifluorométhyl)-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.492
Molar Refractivity: 79.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): -0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.45
ACD/LogD (pH 7.4): -2.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 274.8±3.0 cm3

Click to predict properties on the Chemicalize site


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