ChemSpider 2D Image | 1-[(9E)-9-Octadecenoyloxy]-2,5-dioxo-3-pyrrolidinesulfonic acid | C22H37NO7S

1-[(9E)-9-Octadecenoyloxy]-2,5-dioxo-3-pyrrolidinesulfonic acid

  • Molecular FormulaC22H37NO7S
  • Average mass459.597 Da
  • Monoisotopic mass459.229065 Da
  • ChemSpider ID10775679

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(9E)-9-Octadecenoyloxy]-2,5-dioxo-3-pyrrolidinesulfonic acid [ACD/IUPAC Name]
1-[(9E)-9-Octadecenoyloxy]-2,5-dioxo-3-pyrrolidinsulfonsäure [German] [ACD/IUPAC Name]
3-Pyrrolidinesulfonic acid, 2,5-dioxo-1-[[(9E)-1-oxo-9-octadecen-1-yl]oxy]- [ACD/Index Name]
Acide 1-[(9E)-9-octadecenoyloxy]-2,5-dioxo-3-pyrrolidinesulfonique [French] [ACD/IUPAC Name]
135661-44-8 [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: 1.526
Molar Refractivity: 118.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 384.6±5.0 cm3

Click to predict properties on the Chemicalize site


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