ChemSpider 2D Image | 4-(4-Methyl-3-nitrobenzoyl)-8-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxylic acid | C19H25N3O6

4-(4-Methyl-3-nitrobenzoyl)-8-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxylic acid

  • Molecular FormulaC19H25N3O6
  • Average mass391.418 Da
  • Monoisotopic mass391.174347 Da
  • ChemSpider ID29809661

More details:

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

1-Oxa-4,8-diazaspiro[4.5]decane-3-carboxylic acid, 4-(4-methyl-3-nitrobenzoyl)-8-propyl- [ACD/Index Name]
4-(4-Methyl-3-nitrobenzoyl)-8-propyl-1-oxa-4,8-diazaspiro[4.5]decan-3-carbonsäure [German] [ACD/IUPAC Name]
4-(4-Methyl-3-nitrobenzoyl)-8-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxylic acid [ACD/IUPAC Name]
Acide 4-(4-méthyl-3-nitrobenzoyl)-8-propyl-1-oxa-4,8-diazaspiro[4.5]décane-3-carboxylique [French] [ACD/IUPAC Name]
1326813-01-7 [RN]
atoms 28 bonds 30
MFCD19706428

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

Density: 1.4±0.1 g/cm3
Boiling Point: 612.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 324.2±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 100.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.97
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.94
Polar Surface Area: 116 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 64.9±5.0 dyne/cm
Molar Volume: 287.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement