ChemSpider 2D Image | N-arachidonoyltaurine | C22H37NO4S

N-arachidonoyltaurine

  • Molecular FormulaC22H37NO4S
  • Average mass411.599 Da
  • Monoisotopic mass411.244324 Da
  • ChemSpider ID24842023

  • Double-bond stereo - Double-bond stereo

More details:

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

119959-65-8 [RN]
2-[(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoylamino]ethanesulfonic acid [ACD/IUPAC Name]
2-[(5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoylamino]ethansulfonsäure [German] [ACD/IUPAC Name]
2-[[(5Z,8Z,11Z,14Z)-1-Oxo-5,8,11,14-eicosatetraen-1-yl]amino]ethanesulfonic acid
Acide 2-[(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoylamino]éthanesulfonique [French] [ACD/IUPAC Name]
Ethanesulfonic acid, 2-[[(5Z,8Z,11Z,14Z)-1-oxo-5,8,11,14-eicosatetraen-1-yl]amino]- [ACD/Index Name]
N-Arachidonoyl Taurine
N-arachidonoyltaurine
[119959-65-8] [RN]
2-((5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenamido)ethanesulfonic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.514
Molar Refractivity: 117.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 390.6±3.0 cm3

Click to predict properties on the Chemicalize site


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