ChemSpider 2D Image | (5E)-7-{2-[(1E)-3-Hydroxy-1-decen-1-yl]-5-oxo-1-pyrrolidinyl}-5-heptenoic acid | C21H35NO4

(5E)-7-{2-[(1E)-3-Hydroxy-1-decen-1-yl]-5-oxo-1-pyrrolidinyl}-5-heptenoic acid

  • Molecular FormulaC21H35NO4
  • Average mass365.507 Da
  • Monoisotopic mass365.256622 Da
  • ChemSpider ID57513867

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-7-{2-[(1E)-3-Hydroxy-1-decen-1-yl]-5-oxo-1-pyrrolidinyl}-5-heptenoic acid [ACD/IUPAC Name]
(5E)-7-{2-[(1E)-3-Hydroxy-1-decen-1-yl]-5-oxo-1-pyrrolidinyl}-5-heptensäure [German] [ACD/IUPAC Name]
5-Heptenoic acid, 7-[2-[(1E)-3-hydroxy-1-decen-1-yl]-5-oxo-1-pyrrolidinyl]-, (5E)- [ACD/Index Name]
Acide (5E)-7-{2-[(1E)-3-hydroxy-1-décén-1-yl]-5-oxo-1-pyrrolidinyl}-5-hepténoïque [French] [ACD/IUPAC Name]
62401-50-7 [RN]
7-(2-(3-Hydroxydec-1-en-1-yl)-5-oxopyrrolidin-1-yl)hept-5-enoic acid
7-[2-(3-HYDROXYDEC-1-EN-1-YL)-5-OXOPYRROLIDIN-1-YL]HEPT-5-ENOIC ACID

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

Density: 1.1±0.1 g/cm3
Boiling Point: 567.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.9±6.0 kJ/mol
Flash Point: 297.2±30.1 °C
Index of Refraction: 1.547
Molar Refractivity: 105.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 67.53
ACD/KOC (pH 5.5): 410.85
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 6.54
Polar Surface Area: 78 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 333.9±3.0 cm3

Click to predict properties on the Chemicalize site


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