ChemSpider 2D Image | (2S,4S)-4-Cyclohexyl-1-({[2-methyl-1-(propionyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-2-pyrrolidinecarboxylate | C30H45NO7P

(2S,4S)-4-Cyclohexyl-1-({[2-methyl-1-(propionyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-2-pyrrolidinecarboxylate

  • Molecular FormulaC30H45NO7P
  • Average mass562.655 Da
  • Monoisotopic mass562.293884 Da
  • ChemSpider ID26331487

  • Charge - Charge

    defined stereocentres - 2 of 4 defined stereocentres

More details:

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

(2S,4S)-4-Cyclohexyl-1-({[2-methyl-1-(propionyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-2-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
(2S,4S)-4-Cyclohexyl-1-({[2-methyl-1-(propionyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-2-pyrrolidinecarboxylate [ACD/IUPAC Name]
(2S,4S)-4-Cyclohexyl-1-(2-{[2-méthyl-1-(propionyloxy)propoxy](4-phénylbutyl)phosphoryl}acétyl)-2-pyrrolidinecarboxylate [French] [ACD/IUPAC Name]
L-Proline, 4-cyclohexyl-1-[2-[[2-methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetyl]-, ion(1-), (4S)- [ACD/Index Name]
(2S,4S)-4-cyclohexyl-1-({[2-methyl-1-(propanoyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)pyrrolidine-2-carboxylate
(4S)-4-cyclohexyl-1-({[2-methyl-1-(propanoyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-L-prolinate
fosinopril(1-)

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

6835932 [DBID]

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

Density:
Boiling Point: 705.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 380.6±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 6.09
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 63.62
ACD/KOC (pH 5.5): 170.20
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 2.27
ACD/KOC (pH 7.4): 6.07
Polar Surface Area: 123 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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