ChemSpider 2D Image | 2-{4-[(Allylsulfonyl)amino]phenoxy}tetradecanoic acid | C23H37NO5S

2-{4-[(Allylsulfonyl)amino]phenoxy}tetradecanoic acid

  • Molecular FormulaC23H37NO5S
  • Average mass439.609 Da
  • Monoisotopic mass439.239258 Da
  • ChemSpider ID28698405

More details:

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

2-{4-[(Allylsulfonyl)amino]phenoxy}tetradecanoic acid [ACD/IUPAC Name]
2-{4-[(Allylsulfonyl)amino]phenoxy}tetradecansäure [German] [ACD/IUPAC Name]
Acide 2-{4-[(allylsulfonyl)amino]phénoxy}tétradécanoïque [French] [ACD/IUPAC Name]
Tetradecanoic acid, 2-[4-[(2-propen-1-ylsulfonyl)amino]phenoxy]- [ACD/Index Name]
2-[4-(PROP-2-ENE-1-SULFONAMIDO)PHENOXY]TETRADECANOIC ACID
2-{4-[(Prop-2-ene-1-sulfonyl)amino]phenoxy}tetradecanoic acid
89205-38-9 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 571.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.1±3.0 kJ/mol
Flash Point: 299.2±32.9 °C
Index of Refraction: 1.531
Molar Refractivity: 121.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 7.20
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 282.63
ACD/KOC (pH 5.5): 409.76
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 15.60
ACD/KOC (pH 7.4): 22.61
Polar Surface Area: 101 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 391.6±3.0 cm3

Click to predict properties on the Chemicalize site


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