Found 13 results

Search term: MF = 'C_{16}H_{20}ClNO_{7}'
ChemSpider 2D Image | Diethyl chloro[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]malonate | C16H20ClNO7

Diethyl chloro[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]malonate

  • Molecular FormulaC16H20ClNO7
  • Average mass373.785 Da
  • Monoisotopic mass373.092834 Da
  • ChemSpider ID74162590

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Chloro[(1S)-1-(4-méthoxyphényl)-2-nitroéthyl]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl chloro[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]malonate [ACD/IUPAC Name]
Diethyl-chlor[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-chloro-2-[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]-, diethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 487.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 248.5±28.7 °C
Index of Refraction: 1.520
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 243.57
ACD/KOC (pH 5.5): 1766.72
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 88.94
ACD/KOC (pH 7.4): 645.12
Polar Surface Area: 108 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 293.7±3.0 cm3

Click to predict properties on the Chemicalize site


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