ChemSpider 2D Image | Octyl 3-amino-4-chlorobenzoate | C15H22ClNO2

Octyl 3-amino-4-chlorobenzoate

  • Molecular FormulaC15H22ClNO2
  • Average mass283.794 Da
  • Monoisotopic mass283.133911 Da
  • ChemSpider ID21514018

More details:






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

170425-41-9 [RN]
3-Amino-4-chlorobenzoate d'octyle [French] [ACD/IUPAC Name]
3-Amino-4-Chlorobenzoic Acid Octyl Ester
Benzoic acid, 3-amino-4-chloro-, octyl ester [ACD/Index Name]
Benzoicacid, 3-amino-4-chloro-octylester
Octyl 3-amino-4-chlorobenzoate [ACD/IUPAC Name]
Octyl-3-amino-4-chlorbenzoat [German] [ACD/IUPAC Name]
3-Amino-4-Chlorobenzoic Acid Octyl Ester (en)
3-Amino-4-chlorobenzoic acid octylester
4-diazo-3-hydroxy-3H-naphthalene-1-sulfonic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 391.2±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 190.4±22.3 °C
Index of Refraction: 1.531
Molar Refractivity: 79.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.68
ACD/LogD (pH 5.5): 5.53
ACD/BCF (pH 5.5): 9383.54
ACD/KOC (pH 5.5): 24265.98
ACD/LogD (pH 7.4): 5.53
ACD/BCF (pH 7.4): 9384.43
ACD/KOC (pH 7.4): 24268.30
Polar Surface Area: 52 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 257.1±3.0 cm3

Click to predict properties on the Chemicalize site






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