ChemSpider 2D Image | Benzyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl(~15~N)-1H-pyrrole-2-carboxylate | C18H2115NO4

Benzyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl(15N)-1H-pyrrole-2-carboxylate

  • Molecular FormulaC18H2115NO4
  • Average mass316.357 Da
  • Monoisotopic mass316.144104 Da
  • ChemSpider ID107437194

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrrole-1-15N-3-propanoic acid, 2,4-dimethyl-5-[(phenylmethoxy)carbonyl]-, methyl ester [ACD/Index Name]
4-(3-Méthoxy-3-oxopropyl)-3,5-diméthyl(15N)-1H-pyrrole-2-carboxylate de benzyle [French] [ACD/IUPAC Name]
Benzyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl(15N)-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
Benzyl-4-(3-methoxy-3-oxopropyl)-3,5-dimethyl(15N)-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]
115997-51-8 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.564
Molar Refractivity: 87.2±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 268.2±3.0 cm3

Click to predict properties on the Chemicalize site


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