Found 90 results

Search term: MF = 'C_{17}H_{19}NO_{8}'
ChemSpider 2D Image | (1R,5S)-3-(3,4,5-Trimethoxybenzoyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid | C17H19NO8

(1R,5S)-3-(3,4,5-Trimethoxybenzoyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid

  • Molecular FormulaC17H19NO8
  • Average mass365.335 Da
  • Monoisotopic mass365.111053 Da
  • ChemSpider ID71346929

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5S)-3-(3,4,5-Trimethoxybenzoyl)-3-azabicyclo[3.1.0]hexan-1,5-dicarbonsäure [German] [ACD/IUPAC Name]
(1R,5S)-3-(3,4,5-Trimethoxybenzoyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid [ACD/IUPAC Name]
3-Azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid, 3-(3,4,5-trimethoxybenzoyl)-, (1R,5S)- [ACD/Index Name]
Acide (1R,5S)-3-(3,4,5-triméthoxybenzoyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 641.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 341.8±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 86.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.85
ACD/LogD (pH 5.5): -1.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 74.4±3.0 dyne/cm
Molar Volume: 241.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement