Found 1 result

Search term: LOGOGDCJQQSNJV-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 6-[2-({Isopropyl[4-(3-thienyl)benzoyl]amino}methyl)phenoxy]hexanoic acid | C27H31NO4S

6-[2-({Isopropyl[4-(3-thienyl)benzoyl]amino}methyl)phenoxy]hexanoic acid

  • Molecular FormulaC27H31NO4S
  • Average mass465.604 Da
  • Monoisotopic mass465.197388 Da
  • ChemSpider ID59052381

More details:

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

6-[2-({Isopropyl[4-(3-thienyl)benzoyl]amino}methyl)phenoxy]hexanoic acid [ACD/IUPAC Name]
6-[2-({Isopropyl[4-(3-thienyl)benzoyl]amino}methyl)phenoxy]hexansäure [German] [ACD/IUPAC Name]
Acide 6-[2-({isopropyl[4-(3-thiényl)benzoyl]amino}méthyl)phénoxy]hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 6-[2-[[(1-methylethyl)[4-(3-thienyl)benzoyl]amino]methyl]phenoxy]- [ACD/Index Name]
6-[2-({(Propan-2-Yl)[4-(Thiophen-3-Yl)benzene-1-Carbonyl]amino}methyl)phenoxy]hexanoic Acid
7UY

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

Density: 1.2±0.1 g/cm3
Boiling Point: 652.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 348.5±31.5 °C
Index of Refraction: 1.587
Molar Refractivity: 132.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 428.28
ACD/KOC (pH 5.5): 1546.27
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 6.82
ACD/KOC (pH 7.4): 24.62
Polar Surface Area: 95 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 394.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement